Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02704733
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 |
EPL | DIETHYL 4-METHOXYPHENYL PHOSPHATE | A | 2R1N | 0.71 | |
CTX | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINE | A,B,C | 1YA4 | 0.79 | |
FLN | 2-PHENYL-4H-CHROMEN-4-ONE | A | 2G0L | 0.74 | |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.76 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.74 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.74 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.74 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.74 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.74 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.74 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.74 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.74 | |
NOA | NAPHTHYLOXYACETIC ACID | A,B,I | 1HIV | 0.76 | |
NOA | NAPHTHYLOXYACETIC ACID | I | 1IVP | 0.76 | |
RSO | R-STYRENE OXIDE | A,B | 1PWZ | 0.74 | |
268 | 2-phenoxyethanol | A | 2RBR | 0.78 | |
AZ2 | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A,B | 1I7I | 0.7 | |
AZ2 | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A | 1I7G | 0.7 | |
INK | (RP,SP)-O-(2R)-(1-PHENOXYBUT-2- YL)-METHYLPHOSPHONIC ACID CHLORIDE | A | 1HQD | 0.73 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.76 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.71 | |
ZZ1 | 4-METHYL-2H-CHROMEN-2-ONE | A | 2CIP | 0.79 | |
PET | 1,5-DI(4-AMIDINOPHENOXY)-3-OXA- PENTANE | B | 166D | 0.72 | |
505 | (2R)-1-(2,6-dimethylphenoxy)propan- 2-amine | A | 2VIN | 0.77 | |
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 | 0.76 | |
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 | 0.75 | |
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 | 0.75 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2F4O | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJO | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CDR | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C1E | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 5PAD | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1JXQ | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 2CNO | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1CGL | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ9 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2K | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2CNL | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJP | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2M | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZB | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 9HVP | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1ESB | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1DY8 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 1PPM | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 1GEC | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KS7 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | C | 1A8G | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KKK | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | T,U,V,W,X,Y | 1QDU | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 4TMN | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5TMN | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KTO | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,C | 1TG1 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ8 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 2G58 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | Q,R,S,T,U,V | 1F9E | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CJY | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 1E8M | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KR6 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 6TMN | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KRO | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNN | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2O | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1SQZ | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1THE | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I,J | 2AZC | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5EST | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNK | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KL6 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 6PAD | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | B,I | 2C2Z | 0.72 | |
B76 | A,B | 2E9D | 0.75 | ||
PCR | P-CRESOL | A | 1JHV | 0.71 | |
PCR | P-CRESOL | A | 1JHU | 0.71 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.71 | |
TF5 | 2-[(2',3',4'-TRIFLUOROBIPHENYL- 2-YL)OXY]ETHANOL | A,B | 2OP3 | 0.89 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.71 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.73 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.73 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.73 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.73 | |
24B | (2,4-DIFLUOROPHENYL)METHANOL | A,B | 1QV6 | 0.7 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 3ERT | 0.75 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 1S9Q | 0.75 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 1VJB | 0.75 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B,C,P,R | 2JF9 | 0.75 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B,C,D,E,F | 2GPV | 0.75 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 2GPU | 0.75 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 2P7Z | 0.75 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 2BJ4 | 0.75 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 2FSZ | 0.75 | |
I0G | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2I0G | 0.72 | |
I0G | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B,C,D | 2I0J | 0.72 | |
3AS | (3aS,4R,9bR)-2,2-difluoro-4-(4- hydroxyphenyl)-6-(methoxymethyl)- 1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromen- 8-ol | A,B | 2QTU | 0.71 | |
B65 | (1R)-4-(3-phenoxyphenyl)-1-phosphonobutane- 1-sulfonic acid | A | 2ZCQ | 0.73 | |
OXN | OXTOXYNOL-10 | A | 1IKT | 0.75 | |
OXN | OXTOXYNOL-10 | A,B | 2Q32 | 0.75 | |
OXN | OXTOXYNOL-10 | A,B | 1UEH | 0.75 | |
OXN | OXTOXYNOL-10 | A,B | 2D4Q | 0.75 | |
LJ1 | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.71 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.73 | |
COU | COUMARIN | A | 3CRB | 0.79 | |
COU | COUMARIN | A | 2PMJ | 0.79 | |
COU | COUMARIN | A | 2H90 | 0.79 | |
COU | COUMARIN | A,B,C,D | 1Z10 | 0.79 | |
COU | COUMARIN | A | 2PWB | 0.79 | |
DID | 4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDE | A,B,C,D | 1RPW | 0.73 | |
BR3 | (6-METHYL-3,4-DIHYDRO-2H-CHROMEN- 2-YL)METHYLPHOSPHINATE | A | 1PE5 | 0.78 | |
YRG | (2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid | A | 3CDP | 0.71 | |
SAG | (S)-(+)-2-[4-(FLUOROBENZYLOXY-BENZYLAMINO)PROPIONAMIDE] | A,B | 2V5Z | 0.74 | |
TON | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | A,B | 1SEZ | 0.78 | |
BGG | CARBONIC ACID MONOBENZYL ESTER | B,D | 1DLK | 0.7 | |
WST | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 9-OL | A,B | 2POG | 0.72 | |
261 | 2-ethoxyphenol | X | 2RB1 | 0.73 | |
TNT | 1,3-BIS(AMIDINOPHENOXY)PROPANE | B | 102D | 0.73 | |
TNT | 1,3-BIS(AMIDINOPHENOXY)PROPANE | A | 1PRP | 0.73 | |
SC4 | 1[2-CHLORO-4-METHOXY-PHENYL-OXYMETHYL]- 4-[2,6-DICHLORO-PHENYL-OXYMETHYL]- BENZENE | 1,4 | 1EAH | 0.74 | |
SC4 | 1[2-CHLORO-4-METHOXY-PHENYL-OXYMETHYL]- 4-[2,6-DICHLORO-PHENYL-OXYMETHYL]- BENZENE | 1,4 | 3EPF | 0.74 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.7 | |
CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.7 | |
CRS | M-CRESOL | A,B | 1UZ9 | 0.7 | |
CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.7 | |
CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.7 | |
CRS | M-CRESOL | A,C,D,E | 7INS | 0.7 | |
CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.7 | |
2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IME | 0.73 | |
2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IMD | 0.73 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.77 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.73 | |
T4A | C,D | 1KGI | 0.72 | ||
T4A | A,B | 1Z7J | 0.72 | ||
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.7 | |
PNT | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | X | 3CR4 | 0.72 | |
PNT | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | B | 1D64 | 0.72 | |
PNT | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | X | 3CR5 | 0.72 | |
PNT | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | A,B,D,E | 1RKW | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIT | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ1 | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIU | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PKL | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 3D57 | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ2 | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2QPY | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ0 | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NUO | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 2PIN | 0.73 | |
4MU | 7-hydroxy-4-methyl-2H-chromen-2- one | A,B | 3ETS | 0.7 | |
BPM | 4-PHOSPHONOOXY-PHENYL-METHYL-[4- PHOSPHONOOXY]BENZEN | A | 1AAX | 0.71 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.75 | |
DC8 | (3AS,4R,9BR)-2,2-DIFLUORO-4-(4- HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2Q70 | 0.74 | |
DC8 | (3AS,4R,9BR)-2,2-DIFLUORO-4-(4- HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2Z4B | 0.74 | |
RFX | (3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine | A | 3GWV | 0.79 | |
SFX | (3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine | A | 3GWW | 0.79 | |
PZM | 1-(4-METHOXYPHENYL)METHANAMINE | A,D,H | 2HJB | 0.74 | |
ZHH | 2-(4-METHOXYPHENYL)ETHANAMINE | D,H | 2HKR | 0.75 | |
4BR | 2-(4-METHYLPHENOXY)ETHYLPHOSPHINATE | A | 1PE7 | 0.83 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.7 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.7 | |
4HC | 4-HYDROXY-2H-CHROMEN-2-ONE | A,B | 1V5Y | 0.75 | |
CMZ | (2S)-1-(2,5-dimethylphenoxy)-3- morpholin-4-ylpropan-2-ol | A | 2OF0 | 0.71 | |
JT6 | 3-[(4'-cyanobiphenyl-4-yl)oxy]- N-hydroxypropanamide | A | 2JT6 | 0.71 | |
PFI | (6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO- 4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY- 5,6-DIHYDRO-2H-PYRAN-2-ONE | A | 2HAI | 0.76 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.72 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B | 1QV7 | 0.7 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B,C,D | 1MG0 | 0.7 | |
DR6 | ALPHA-[4-(1,1,3,3 - TETRAMETHYLBUTYL)PHENYL]- OMEGA-HYDROXY-POLY(OXY-1,2-ETHANEDIYL) | C,I,T | 1YTZ | 0.75 | |
258 | (2-chloroethoxy)benzene | X | 2RAY | 0.79 | |
G24 | [4-(3-BENZYL-4-HYDROXYBENZYL)-3,5- DIMETHYLPHENOXY]ACETIC ACID | A | 1Q4X | 0.71 | |
TRT | FRAGMENT OF TRITON X-100 | A,E | 2I0U | 0.8 | |
TRT | FRAGMENT OF TRITON X-100 | A,B | 1OIZ | 0.8 | |
TXF | (Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}- 5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL | A,B,C,D,E | 2EWP | 0.74 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.73 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.73 | |
TN1 | 5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL | A | 1YSG | 0.71 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3B3K | 0.72 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3D6D | 0.72 | |
BZF | BENZOFURAN | A | 182L | 0.74 | |
1NP | 1-NAPHTHOL | X | 2ZVQ | 0.7 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.71 | |
POT | (1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATE | A | 2NW6 | 0.73 | |
TAX | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINIUM | A | 1FJ5 | 0.75 |