Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02429344
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
8PP | 2-[(2E,6E,10E,14E,18E,22E,26E)- 3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA- 2,6,10,14,18,22,26,30-OCTAENYL]PHENOL | A,B,C,D | 1Y0G | 0.7 | |
MUG | 4-METHYLUMBELLIFERYL-ALPHA-D-GLUCOSE | A,B,C,D | 1CJP | 0.73 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.82 | |
DDC | 7-HYDROXY-2-PHENYL-CHROMAN-4-ONE | A,B | 1FM8 | 0.71 | |
WRS | 4-HYDROXY-3-[(1S,3S)-3-HYDROXY- 1-PHENYLBUTYL]-2H-CHROMEN-2-ONE | A | 1HA2 | 0.74 | |
258 | (2-chloroethoxy)benzene | X | 2RAY | 0.74 | |
EPL | DIETHYL 4-METHOXYPHENYL PHOSPHATE | A | 2R1N | 0.71 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.8 | |
OXN | OXTOXYNOL-10 | A | 1IKT | 0.78 | |
OXN | OXTOXYNOL-10 | A,B | 2Q32 | 0.78 | |
OXN | OXTOXYNOL-10 | A,B | 1UEH | 0.78 | |
OXN | OXTOXYNOL-10 | A,B | 2D4Q | 0.78 | |
FLN | 2-PHENYL-4H-CHROMEN-4-ONE | A | 2G0L | 0.74 | |
R12 | 9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)- 3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID | A | 3CBS | 0.73 | |
CFA | (2,4-DICHLOROPHENOXY)ACETIC ACID | B,E | 2P1N | 0.7 | |
261 | 2-ethoxyphenol | X | 2RB1 | 0.77 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.82 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.82 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.82 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.82 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.82 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.82 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | B,D,E,F | 2VSS | 0.76 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | A,B,D,E,F | 2VSU | 0.76 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.73 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.73 | |
3HB | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.72 | |
3HB | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.72 | |
FDS | FLUORESCIN | H | 4FAB | 0.71 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.75 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.75 | |
WRR | 4-HYDROXY-3-[(1S,3R)-3-HYDROXY- 1-PHENYLBUTYL]-2H-CHROMEN-2-ONE | A | 1H9Z | 0.74 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IME | 0.78 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IMD | 0.78 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.73 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.73 | |
CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.73 | |
CRS | M-CRESOL | A,B | 1UZ9 | 0.73 | |
CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.73 | |
CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.73 | |
CRS | M-CRESOL | A,C,D,E | 7INS | 0.73 | |
CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.73 | |
BRZ | 6-(1,1-DIMETHYLALLYL)-2-(1-HYDROXY- 1-METHYLETHYL)-2,3-DIHYDRO-7H-FURO[3,2- G]CHROMEN-7-ONE | C | 1K3T | 0.73 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.72 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.72 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.72 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.72 | |
FRR | (3R,5Z,8S,9S,11E)-8,9,16-TRIHYDROXY- 14-METHOXY-3-METHYL-3,4,9,10-TETRAHYDRO- 1H-2-BENZOXACYCLOTETRADECINE-1,7(8H)- DIONE | A | 2E14 | 0.7 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.71 | |
MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.71 | |
MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.71 | |
BGG | CARBONIC ACID MONOBENZYL ESTER | B,D | 1DLK | 0.75 | |
HHH | (2S)-hydroxy(4-hydroxyphenyl)ethanoic acid | A,B | 2R5V | 0.71 | |
RWF | R-WARFARIN | A,B | 2BXD | 0.74 | |
DHC | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.78 | |
DHC | CAFFEIC ACID | A | 1KOU | 0.78 | |
3MB | 3-METHOXYBENZAMIDE | A | 3PAX | 0.71 | |
505 | (2R)-1-(2,6-dimethylphenoxy)propan- 2-amine | A | 2VIN | 0.73 | |
WST | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 9-OL | A,B | 2POG | 0.7 | |
VII | 2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID | A,B | 2GFK | 0.7 | |
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.72 | |
3A3 | A | 2CGU | 0.71 | ||
CMZ | (2S)-1-(2,5-dimethylphenoxy)-3- morpholin-4-ylpropan-2-ol | A | 2OF0 | 0.7 | |
YZ9 | 7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER | A,B,C | 1GCZ | 0.83 | |
L41 | {4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid | A,B | 3D5F | 0.7 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.82 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.82 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.82 | |
HFL | 5-(3,3-DIHYDROXYPROPENY)-3-METHOXY- BENZENE-1,2-DIOL | C,F | 1KYW | 0.74 | |
U03 | 4-HYDROXY-7-METHOXY-3-(1-PHENYL- PROPYL)-CHROMEN-2-ONE | A | 3UPJ | 0.75 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | H,I | 1A2C | 0.73 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C | 1CA7 | 0.73 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C,D | 3GGO | 0.73 | |
EAA | ETHACRYNIC ACID | A,B | 3DGQ | 0.71 | |
EAA | ETHACRYNIC ACID | A,B | 11GS | 0.71 | |
EAA | ETHACRYNIC ACID | A,B,C,D | 1GSF | 0.71 | |
EAA | ETHACRYNIC ACID | A,B | 2GSS | 0.71 | |
EAA | ETHACRYNIC ACID | A,B | 3GSS | 0.71 | |
EAA | ETHACRYNIC ACID | A,B | 1GSE | 0.71 | |
TF5 | 2-[(2',3',4'-TRIFLUOROBIPHENYL- 2-YL)OXY]ETHANOL | A,B | 2OP3 | 0.77 | |
2E3 | (2E)-3-[4-hydroxy-3-(3,5,5,8,8- pentamethyl-5,6,7,8-tetrahydronaphthalen- 2-yl)phenyl]prop-2-enoic acid | A | 3FUG | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1K03 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 2VQ5 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1EB9 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 2GQ9 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1Z42 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1OYB | 0.73 | |
AZ2 | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A,B | 1I7I | 0.75 | |
AZ2 | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A | 1I7G | 0.75 | |
HC4 | A | 1TS6 | 0.84 | ||
HC4 | A | 3PHY | 0.84 | ||
HC4 | A | 3PYP | 0.84 | ||
HC4 | A | 1T1C | 0.84 | ||
HC4 | A | 1OT6 | 0.84 | ||
HC4 | A | 1TS0 | 0.84 | ||
HC4 | A | 1T1A | 0.84 | ||
HC4 | A | 2PYP | 0.84 | ||
HC4 | A | 2ZOI | 0.84 | ||
HC4 | A | 1OTI | 0.84 | ||
HC4 | A | 1XFQ | 0.84 | ||
HC4 | A | 2D01 | 0.84 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7B | 0.84 | ||
HC4 | A | 2ZOH | 0.84 | ||
HC4 | A | 1GSW | 0.84 | ||
HC4 | A | 2QJ7 | 0.84 | ||
HC4 | A | 1F9I | 0.84 | ||
HC4 | X | 1UWP | 0.84 | ||
HC4 | A | 2PHY | 0.84 | ||
HC4 | A | 1T1B | 0.84 | ||
HC4 | A | 1F98 | 0.84 | ||
HC4 | A | 1T19 | 0.84 | ||
HC4 | X | 1UWN | 0.84 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7F | 0.84 | ||
HC4 | A | 1UGU | 0.84 | ||
HC4 | A | 1TS8 | 0.84 | ||
HC4 | A,B | 1OTD | 0.84 | ||
HC4 | A | 1OTE | 0.84 | ||
HC4 | A | 1GSX | 0.84 | ||
HC4 | A | 1TS7 | 0.84 | ||
HC4 | A | 2PYR | 0.84 | ||
HC4 | A | 1S4S | 0.84 | ||
HC4 | A | 1GSV | 0.84 | ||
HC4 | A | 2I9V | 0.84 | ||
HC4 | A | 2QWS | 0.84 | ||
HC4 | A | 1XFN | 0.84 | ||
HC4 | A | 1S4R | 0.84 | ||
HC4 | A | 1T18 | 0.84 | ||
HC4 | A | 1OTA | 0.84 | ||
HC4 | A | 1D7E | 0.84 | ||
HC4 | A | 1S1Z | 0.84 | ||
HC4 | A,B,C | 1MZU | 0.84 | ||
HC4 | A,B | 1ODV | 0.84 | ||
HC4 | A,B | 2J3J | 0.84 | ||
HC4 | A | 2QJ5 | 0.84 | ||
HC4 | A | 1OTB | 0.84 | ||
HC4 | A | 2D02 | 0.84 | ||
HC4 | A | 1OT9 | 0.84 | ||
HC4 | A | 1NWZ | 0.84 | ||
HC4 | A | 1S1Y | 0.84 | ||
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2F4O | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJO | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CDR | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C1E | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 5PAD | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1JXQ | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 2CNO | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1CGL | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ9 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2K | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2CNL | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJP | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2M | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZB | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 9HVP | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1ESB | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1DY8 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 1PPM | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 1GEC | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KS7 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | C | 1A8G | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KKK | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | T,U,V,W,X,Y | 1QDU | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 4TMN | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5TMN | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KTO | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,C | 1TG1 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ8 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 2G58 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | Q,R,S,T,U,V | 1F9E | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CJY | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 1E8M | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KR6 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 6TMN | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KRO | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNN | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2O | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1SQZ | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1THE | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I,J | 2AZC | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5EST | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNK | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KL6 | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 6PAD | 0.73 | |
PHQ | FORMIC ACID BENZYL ESTER | B,I | 2C2Z | 0.73 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.72 | |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.73 | |
G24 | [4-(3-BENZYL-4-HYDROXYBENZYL)-3,5- DIMETHYLPHENOXY]ACETIC ACID | A | 1Q4X | 0.77 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.76 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.76 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.75 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.75 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.75 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.75 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.75 | |
8CM | 8-HYDROXYCOUMARIN | A | 2H8Z | 0.8 | |
VXX | VANILLATE | A,B | 1WB6 | 0.75 | |
ZHZ | 2-(4-METHOXYPHENYL)ACETAMIDE | D,H | 2HKR | 0.74 | |
I0G | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2I0G | 0.7 | |
I0G | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B,C,D | 2I0J | 0.7 | |
T3O | 4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3- OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL | A,B | 2G44 | 0.71 | |
2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IME | 0.79 | |
2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IMD | 0.79 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | L | 1FLR | 0.71 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A,B | 1N0S | 0.71 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | C,L | 1T66 | 0.71 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A | 1X9Q | 0.71 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A,D | 2NMV | 0.71 | |
3TN | (2E)-3-[4-HYDROXY-3-(3-METHOXY- 5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN- 2-YL)PHENYL]ACRYLIC ACID | A | 2P1T | 0.77 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 3ERT | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 1S9Q | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 1VJB | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B,C,P,R | 2JF9 | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B,C,D,E,F | 2GPV | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 2GPU | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 2P7Z | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 2BJ4 | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 2FSZ | 0.74 | |
EGC | 2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3- TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}- ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)- ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL | A,B | 1JP3 | 0.78 | |
EGC | 2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3- TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}- ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)- ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL | A | 2W22 | 0.78 | |
INK | (RP,SP)-O-(2R)-(1-PHENOXYBUT-2- YL)-METHYLPHOSPHONIC ACID CHLORIDE | A | 1HQD | 0.72 | |
G12 | 3,8-DIBROMO-7-HYDROXY-4-METHYL- 2H-CHROMEN-2-ONE | A | 2QC6 | 0.73 | |
4MU | 7-hydroxy-4-methyl-2H-chromen-2- one | A,B | 3ETS | 0.83 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.83 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.83 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.83 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.83 | |
ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.83 | |
T4A | C,D | 1KGI | 0.77 | ||
T4A | A,B | 1Z7J | 0.77 | ||
YRG | (2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid | A | 3CDP | 0.73 | |
4TN | (2E)-3-[3-(3-ETHOXY-5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)-4-HYDROXYPHENYL]ACRYLIC ACID | A | 2P1U | 0.8 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.71 | |
ZHH | 2-(4-METHOXYPHENYL)ETHANAMINE | D,H | 2HKR | 0.74 | |
NOA | NAPHTHYLOXYACETIC ACID | A,B,I | 1HIV | 0.78 | |
NOA | NAPHTHYLOXYACETIC ACID | I | 1IVP | 0.78 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | B,C,D | 2VK0 | 0.79 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | A,B,D | 3MTH | 0.79 | |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.86 | |
TRT | FRAGMENT OF TRITON X-100 | A,E | 2I0U | 0.79 | |
TRT | FRAGMENT OF TRITON X-100 | A,B | 1OIZ | 0.79 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.7 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ4 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOB | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXB | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1G1B | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1YKJ | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUV | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PBE | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCC | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PDH | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUW | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC4 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC6 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUW | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1FW9 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1G81 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGJ | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUX | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ3 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1D7L | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 2PHH | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGN | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXA | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOC | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1K0I | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BKW | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1JD3 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXC | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1TT8 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ2 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1Q4S | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BF3 | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUR | 0.73 | |
POT | (1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATE | A | 2NW6 | 0.72 | |
FHB | 3-FLUORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCF | 0.71 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.87 | |
CTX | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINE | A,B,C | 1YA4 | 0.72 | |
NPS | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | A | 2VDB | 0.74 | |
U01 | 3-[1-(4-BROMO-PHENYL)-2-METHYL- PROPYL]-4-HYDROXY-CHROMEN-2-ONE | A | 1UPJ | 0.71 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3B3K | 0.75 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3D6D | 0.75 | |
PZM | 1-(4-METHOXYPHENYL)METHANAMINE | A,D,H | 2HJB | 0.73 | |
KOM | 7,8-dihydroxy-4-phenyl-2H-chromen- 2-one | A | 2ZVJ | 0.73 | |
SXX | SINAPINATE | A,B | 1WB4 | 0.81 | |
DR6 | ALPHA-[4-(1,1,3,3 - TETRAMETHYLBUTYL)PHENYL]- OMEGA-HYDROXY-POLY(OXY-1,2-ETHANEDIYL) | C,I,T | 1YTZ | 0.77 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I2Z | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C | 1FIQ | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I30 | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1PTH | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3DEU | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C,D | 2E1Q | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3HGX | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3BPX | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1WYG | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1JGS | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | X | 1M6E | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 3B9M | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1FO4 | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1Y7I | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 2FN1 | 0.71 | |
268 | 2-phenoxyethanol | A | 2RBR | 0.79 | |
PFI | (6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO- 4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY- 5,6-DIHYDRO-2H-PYRAN-2-ONE | A | 2HAI | 0.82 | |
DFV | 7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE | B,C | 1JX1 | 0.7 | |
DFV | 7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE | A,B | 1JX0 | 0.7 | |
DFV | 7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE | A,B | 1FM7 | 0.7 | |
ZZ1 | 4-METHYL-2H-CHROMEN-2-ONE | A | 2CIP | 0.86 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.7 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.7 | |
TON | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | A,B | 1SEZ | 0.8 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,C,E | 1KYZ | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1JT2 | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 6ATJ | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1GKL | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GWT | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B,C | 2BJH | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GW2 | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 3CBG | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 2BNJ | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1UWC | 0.86 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 7ATJ | 0.86 | |
OHP | (2-HYDROXYPHENYL)ACETIC ACID | A | 2INZ | 0.72 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.76 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.76 | |
4BR | 2-(4-METHYLPHENOXY)ETHYLPHOSPHINATE | A | 1PE7 | 0.83 | |
OFF | 2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]- L-THREO-PENTARIC ACID | A | 2OFF | 0.72 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.78 | |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.75 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.79 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIT | 0.78 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ1 | 0.78 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIU | 0.78 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PKL | 0.78 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 3D57 | 0.78 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ2 | 0.78 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2QPY | 0.78 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ0 | 0.78 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NUO | 0.78 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 2PIN | 0.78 | |
458 | 4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 8-METHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 2B1V | 0.7 | |
TXF | (Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}- 5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL | A,B,C,D,E | 2EWP | 0.73 | |
MTJ | N,O-DIMETHYL-L-TYROSINE | A,B | 1ATL | 0.71 | |
YR3 | (2S)-3-{4-[1-ethyl-1-(4-{[(2R)- 2-hydroxy-3,3-dimethylbutyl]oxy}- 3-methylphenyl)propyl]-2-methylphenoxy}propane- 1,2-diol | A | 2ZFX | 0.74 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.75 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.79 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.79 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.79 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.79 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.79 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.79 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.79 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.79 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.75 | |
4HC | 4-HYDROXY-2H-CHROMEN-2-ONE | A,B | 1V5Y | 0.85 | |
HXP | 3,6-DIHYDROXY-XANTHENE-9-PROPIONIC ACID | A | 1XAN | 0.72 | |
BR3 | (6-METHYL-3,4-DIHYDRO-2H-CHROMEN- 2-YL)METHYLPHOSPHINATE | A | 1PE5 | 0.76 | |
BZF | BENZOFURAN | A | 182L | 0.73 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.86 | |
DFL | 2-(4-HYDROXY-PHENYL)-CHROMAN-4- ONE | A,B | 1JEP | 0.74 | |
5TN | (2E)-3-[4-HYDROXY-3-(5,5,8,8-TETRAMETHYL- 3-PROPOXY-5,6,7,8-TETRAHYDRONAPHTHALEN- 2-YL)PHENYL]ACRYLIC ACID | A | 2P1V | 0.79 | |
OAC | TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE | C | 3GCH | 0.71 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.85 | |
HZ3 | dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)- 7-oxabicyclo[2.2.1]hepta-2,5-diene- 2,3-dicarboxylate | A,B | 2QR9 | 0.73 | |
667 | 6-OXO-8,9,10,11-TETRAHYDRO-7H-CYCLOHEPTA[C][1]BENZOPYRAN- 3-O-SULFAMATE | A | 1TTM | 0.71 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.72 | |
SN1 | 2,4-DIHYDROXY-TRANS CINNAMIC ACID | 1 | 1K2I | 0.77 | |
HOM | 7-HYDROXY-4-METHYL-3-(2-HYDROXY- ETHYL)COUMARIN | C,D | 1CJF | 0.8 | |
MAX | MATAIRESINOL | A | 2BGM | 0.73 | |
SWF | S-WARFARIN | A,B | 1OG5 | 0.74 | |
COU | COUMARIN | A | 3CRB | 0.86 | |
COU | COUMARIN | A | 2PMJ | 0.86 | |
COU | COUMARIN | A | 2H90 | 0.86 | |
COU | COUMARIN | A,B,C,D | 1Z10 | 0.86 | |
COU | COUMARIN | A | 2PWB | 0.86 | |
CA2 | (1S,3R,4R,5S)-1,3,4-TRIHYDROXY- 5-(3-PHENOXYPROPYL)CYCLOHEXANECARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2BT4 | 0.7 | |
FX3 | 5-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop- 2-enoyl]-alpha-L-ribofuranose | A | 2VGD | 0.78 | |
IHB | 3-IODO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCI | 0.71 | |
CIO | CILOMILAST | A,B | 1XOM | 0.71 | |
CIO | CILOMILAST | A,B | 1XLX | 0.71 | |
PCR | P-CRESOL | A | 1JHV | 0.75 | |
PCR | P-CRESOL | A | 1JHU | 0.75 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.75 |