Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02262837
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 |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.75 | |
EYK | 2-tert-butylbenzene-1,4-diol | D,F | 3EYM | 0.75 | |
EYK | 2-tert-butylbenzene-1,4-diol | B | 3EYK | 0.75 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.74 | |
CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.74 | |
CRS | M-CRESOL | A,B | 1UZ9 | 0.74 | |
CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.74 | |
CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.74 | |
CRS | M-CRESOL | A,C,D,E | 7INS | 0.74 | |
CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.74 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2F4O | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJO | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CDR | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C1E | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 5PAD | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1JXQ | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 2CNO | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1CGL | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ9 | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2K | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2CNL | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJP | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2M | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZB | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 9HVP | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1ESB | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1DY8 | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 1PPM | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 1GEC | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KS7 | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | C | 1A8G | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KKK | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | T,U,V,W,X,Y | 1QDU | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 4TMN | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5TMN | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KTO | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A,C | 1TG1 | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ8 | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 2G58 | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | Q,R,S,T,U,V | 1F9E | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CJY | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 1E8M | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KR6 | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 6TMN | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KRO | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNN | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2O | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1SQZ | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1THE | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I,J | 2AZC | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5EST | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNK | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KL6 | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 6PAD | 0.7 | |
PHQ | FORMIC ACID BENZYL ESTER | B,I | 2C2Z | 0.7 | |
4TN | (2E)-3-[3-(3-ETHOXY-5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)-4-HYDROXYPHENYL]ACRYLIC ACID | A | 2P1U | 0.73 | |
OX5 | 4-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIME | A,B,C | 2OOZ | 0.74 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.73 | |
NOA | NAPHTHYLOXYACETIC ACID | A,B,I | 1HIV | 0.71 | |
NOA | NAPHTHYLOXYACETIC ACID | I | 1IVP | 0.71 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.75 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.75 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.7 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.7 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.79 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.79 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.79 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.76 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.74 | |
PFI | (6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO- 4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY- 5,6-DIHYDRO-2H-PYRAN-2-ONE | A | 2HAI | 0.73 | |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.76 | |
4MU | 7-hydroxy-4-methyl-2H-chromen-2- one | A,B | 3ETS | 0.76 | |
OX3 | 4-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOH | 0.71 | |
NIU | 6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE | A | 6UPJ | 0.71 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.71 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.71 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.71 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | H,I | 1A2C | 0.77 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C | 1CA7 | 0.77 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C,D | 3GGO | 0.77 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.75 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.75 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.75 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.75 | |
ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.75 | |
FHB | 3-FLUORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCF | 0.72 | |
T4A | C,D | 1KGI | 0.71 | ||
T4A | A,B | 1Z7J | 0.71 | ||
HBA | P-HYDROXYBENZALDEHYDE | A | 1K03 | 0.72 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 2VQ5 | 0.72 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1EB9 | 0.72 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 2GQ9 | 0.72 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1Z42 | 0.72 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1OYB | 0.72 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.77 | |
TYB | TYROSINAL | A,B | 1KDZ | 0.71 | |
TYB | TYROSINAL | A | 1Q11 | 0.71 | |
TYB | TYROSINAL | A,B | 2J5B | 0.71 | |
TYB | TYROSINAL | A,I | 1GA4 | 0.71 | |
TYB | TYROSINAL | A,B,C | 1NLU | 0.71 | |
TYB | TYROSINAL | A,B | 1KE1 | 0.71 | |
TYB | TYROSINAL | A,B | 1H3F | 0.71 | |
TYB | TYROSINAL | A,B | 1H3E | 0.71 | |
IM3 | (2E)-3-(3,4-DIHYDROXYPHENYL)-2- IMINOPROPANOIC ACID | A,B,C,D | 2E82 | 0.71 | |
OMD | 2-(3,6-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1AJP | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,C,E | 1KYZ | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1JT2 | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 6ATJ | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1GKL | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GWT | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B,C | 2BJH | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GW2 | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 3CBG | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 2BNJ | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1UWC | 0.76 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 7ATJ | 0.76 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.71 | |
MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.71 | |
MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.71 | |
TN1 | 5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL | A | 1YSG | 0.73 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.7 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.7 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.7 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.7 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.7 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.72 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.72 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.72 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.72 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.71 | |
458 | 4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 8-METHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 2B1V | 0.71 | |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.74 | |
BGG | CARBONIC ACID MONOBENZYL ESTER | B,D | 1DLK | 0.72 | |
GRE | 2,6-DIHYDROXYBENZOIC ACID | A,B,C,D | 2DVU | 0.72 | |
IHB | 3-IODO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCI | 0.72 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.71 | |
H53 | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FF5 | 0.72 | |
H53 | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FET | 0.72 | |
SCL | ACETIC ACID SALICYLOYL-AMINO-ESTER | A | 1EBV | 0.71 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.72 | |
4MA | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.71 | |
OHP | (2-HYDROXYPHENYL)ACETIC ACID | A | 2INZ | 0.8 | |
459 | 4-[(1S,2S,5S,9R)-5-(HYDROXYMETHYL)- 8,9-DIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 2FAI | 0.7 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.75 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.75 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.75 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.75 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I2Z | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C | 1FIQ | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I30 | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1PTH | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3DEU | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C,D | 2E1Q | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3HGX | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3BPX | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1WYG | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1JGS | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | X | 1M6E | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 3B9M | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1FO4 | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1Y7I | 0.75 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 2FN1 | 0.75 | |
BHQ | 2,5-DITERT-BUTYLBENZENE-1,4-DIOL | A,B | 2AGV | 0.71 | |
SDN | [(3S)-9-hydroxy-1-methyl-10-oxo- 4,10-dihydro-3H-benzo[g]isochromen- 3-yl]acetic acid | A,B | 3B6C | 0.71 | |
3HB | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.75 | |
3HB | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.75 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 3HF0 | 0.72 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 2OXK | 0.72 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A,B,C | 2OXJ | 0.72 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.76 | |
1NP | 1-NAPHTHOL | X | 2ZVQ | 0.71 | |
RMN | (R)-MANDELIC ACID | A | 1MDL | 0.71 | |
RMN | (R)-MANDELIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1MCZ | 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 | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2D98 | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 2D8P | 0.71 | |
IYR | 3-IODO-TYROSINE | A,B | 3GFD | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 2R1Q | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 2ZP1 | 0.71 | |
IYR | 3-IODO-TYROSINE | A,B,C,D | 2ZXV | 0.71 | |
IYR | 3-IODO-TYROSINE | C | 1CF0 | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 1XXZ | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 2D97 | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 1XY9 | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 2Z10 | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 1WQ3 | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 2D8O | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 2D8W | 0.71 | |
IYR | 3-IODO-TYROSINE | A | 2Z11 | 0.71 | |
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.7 | |
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 | 0.72 | |
ZZ1 | 4-METHYL-2H-CHROMEN-2-ONE | A | 2CIP | 0.77 | |
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 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.84 | |
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 | 0.76 | |
COU | COUMARIN | A | 3CRB | 0.74 | |
COU | COUMARIN | A | 2PMJ | 0.74 | |
COU | COUMARIN | A | 2H90 | 0.74 | |
COU | COUMARIN | A,B,C,D | 1Z10 | 0.74 | |
COU | COUMARIN | A | 2PWB | 0.74 | |
PFL | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.75 | |
HZ3 | dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)- 7-oxabicyclo[2.2.1]hepta-2,5-diene- 2,3-dicarboxylate | A,B | 2QR9 | 0.77 | |
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 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.74 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.74 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.74 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.74 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.74 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.74 | |
BPY | BIPHENYL-2,3-DIOL | A | 1KMY | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | A | 1EIR | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KWC | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.71 | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.74 | |
DIU | 2-HYDROXY-3,5-DIIODO-BENZOIC ACID | A,B | 3B56 | 0.71 | |
DIU | 2-HYDROXY-3,5-DIIODO-BENZOIC ACID | A | 2BXL | 0.71 | |
DHR | (2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE | A,B | 1E55 | 0.8 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.72 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.81 | |
HDI | 3-(4-HYDROXYPHENYL)-4,5-DIHYDRO- 5-ISOXAZOLE-ACETIC ACID METHYL ESTER | A,B,C | 1LJT | 0.73 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.77 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.72 | |
MXN | (2R)-hydroxy(phenyl)ethanenitrile | A,B | 3GDN | 0.73 | |
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 | 0.74 | |
SMN | (S)-MANDELIC ACID | A | 1MDL | 0.71 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.71 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.7 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ4 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOB | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXB | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1G1B | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1YKJ | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUV | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PBE | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCC | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PDH | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUW | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC4 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC6 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUW | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1FW9 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1G81 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGJ | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUX | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ3 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1D7L | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 2PHH | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGN | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXA | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOC | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1K0I | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BKW | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1JD3 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXC | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1TT8 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ2 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1Q4S | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BF3 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUR | 0.74 | |
HE7 | 4-{[(14beta,17alpha)-3-hydroxyestra- 1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | A,B,C,D | 2Z77 | 0.71 | |
4HC | 4-HYDROXY-2H-CHROMEN-2-ONE | A,B | 1V5Y | 0.77 | |
DHC | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.76 | |
DHC | CAFFEIC ACID | A | 1KOU | 0.76 | |
HOM | 7-HYDROXY-4-METHYL-3-(2-HYDROXY- ETHYL)COUMARIN | C,D | 1CJF | 0.76 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.73 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.73 | |
SXX | SINAPINATE | A,B | 1WB4 | 0.71 | |
OFF | 2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]- L-THREO-PENTARIC ACID | A | 2OFF | 0.72 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.71 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.71 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.71 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.71 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.71 | |
OAC | TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE | C | 3GCH | 0.79 | |
UIN | 5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE | B | 5UPJ | 0.71 | |
T3O | 4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3- OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL | A,B | 2G44 | 0.72 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.78 | |
MTY | META-TYROSINE | A | 2TOH | 0.71 | |
MTY | META-TYROSINE | A,B | 1BIQ | 0.71 | |
MTY | META-TYROSINE | A | 1Q7O | 0.71 | |
SN1 | 2,4-DIHYDROXY-TRANS CINNAMIC ACID | 1 | 1K2I | 0.78 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IME | 0.82 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IMD | 0.82 | |
G24 | [4-(3-BENZYL-4-HYDROXYBENZYL)-3,5- DIMETHYLPHENOXY]ACETIC ACID | A | 1Q4X | 0.71 | |
ODE | DIETHYL (1R,2S,3R,4S)-5,6-BIS(4- HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT- 5-ENE-2,3-DICARBOXYLATE | A,B | 2QH6 | 0.72 | |
HC4 | A | 1TS6 | 0.82 | ||
HC4 | A | 3PHY | 0.82 | ||
HC4 | A | 3PYP | 0.82 | ||
HC4 | A | 1T1C | 0.82 | ||
HC4 | A | 1OT6 | 0.82 | ||
HC4 | A | 1TS0 | 0.82 | ||
HC4 | A | 1T1A | 0.82 | ||
HC4 | A | 2PYP | 0.82 | ||
HC4 | A | 2ZOI | 0.82 | ||
HC4 | A | 1OTI | 0.82 | ||
HC4 | A | 1XFQ | 0.82 | ||
HC4 | A | 2D01 | 0.82 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7B | 0.82 | ||
HC4 | A | 2ZOH | 0.82 | ||
HC4 | A | 1GSW | 0.82 | ||
HC4 | A | 2QJ7 | 0.82 | ||
HC4 | A | 1F9I | 0.82 | ||
HC4 | X | 1UWP | 0.82 | ||
HC4 | A | 2PHY | 0.82 | ||
HC4 | A | 1T1B | 0.82 | ||
HC4 | A | 1F98 | 0.82 | ||
HC4 | A | 1T19 | 0.82 | ||
HC4 | X | 1UWN | 0.82 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7F | 0.82 | ||
HC4 | A | 1UGU | 0.82 | ||
HC4 | A | 1TS8 | 0.82 | ||
HC4 | A,B | 1OTD | 0.82 | ||
HC4 | A | 1OTE | 0.82 | ||
HC4 | A | 1GSX | 0.82 | ||
HC4 | A | 1TS7 | 0.82 | ||
HC4 | A | 2PYR | 0.82 | ||
HC4 | A | 1S4S | 0.82 | ||
HC4 | A | 1GSV | 0.82 | ||
HC4 | A | 2I9V | 0.82 | ||
HC4 | A | 2QWS | 0.82 | ||
HC4 | A | 1XFN | 0.82 | ||
HC4 | A | 1S4R | 0.82 | ||
HC4 | A | 1T18 | 0.82 | ||
HC4 | A | 1OTA | 0.82 | ||
HC4 | A | 1D7E | 0.82 | ||
HC4 | A | 1S1Z | 0.82 | ||
HC4 | A,B,C | 1MZU | 0.82 | ||
HC4 | A,B | 1ODV | 0.82 | ||
HC4 | A,B | 2J3J | 0.82 | ||
HC4 | A | 2QJ5 | 0.82 | ||
HC4 | A | 1OTB | 0.82 | ||
HC4 | A | 2D02 | 0.82 | ||
HC4 | A | 1OT9 | 0.82 | ||
HC4 | A | 1NWZ | 0.82 | ||
HC4 | A | 1S1Y | 0.82 | ||
R12 | 9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)- 3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID | A | 3CBS | 0.76 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.71 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.71 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.71 | |
YOF | 3-FLUOROTYROSINE | A,B | 1XIL | 0.71 | |
YOF | 3-FLUOROTYROSINE | A,B | 1XDC | 0.71 | |
YOF | 3-FLUOROTYROSINE | A | 1RRX | 0.71 | |
YOF | 3-FLUOROTYROSINE | A,B | 3FYG | 0.71 | |
689 | 4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 6,8,9-TRIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 1ZKY | 0.7 | |
YZ9 | 7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER | A,B,C | 1GCZ | 0.75 | |
8CM | 8-HYDROXYCOUMARIN | A | 2H8Z | 0.73 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.8 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.8 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.72 | |
LJ1 | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.72 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.76 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.71 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.71 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.71 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.71 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.71 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.71 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.71 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.71 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.8 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.8 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.8 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.8 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.8 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.72 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.72 | |
HHH | (2S)-hydroxy(4-hydroxyphenyl)ethanoic acid | A,B | 2R5V | 0.75 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.75 | |
CIO | CILOMILAST | A,B | 1XOM | 0.71 | |
CIO | CILOMILAST | A,B | 1XLX | 0.71 | |
DTY | D-TYROSINE | A | 1C4B | 0.73 | |
DTY | D-TYROSINE | A,L | 1ZEA | 0.73 | |
DTY | D-TYROSINE | A,B,C,D,E,F, G,H | 1OF6 | 0.73 | |
DTY | D-TYROSINE | A,B | 1UNO | 0.73 | |
DTY | D-TYROSINE | A | 2IGZ | 0.73 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5D | 0.73 | |
DTY | D-TYROSINE | A,B | 2Q33 | 0.73 | |
DTY | D-TYROSINE | H,S | 2H9E | 0.73 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5B | 0.73 | |
DTY | D-TYROSINE | A | 2IH0 | 0.73 | |
DTY | D-TYROSINE | A | 1D7T | 0.73 | |
DTY | D-TYROSINE | A,B | 1XA0 | 0.73 | |
MNN | (S)-MANDELIC ACID NITRILE | A | 1YB6 | 0.73 | |
PCR | P-CRESOL | A | 1JHV | 0.75 | |
PCR | P-CRESOL | A | 1JHU | 0.75 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.75 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIT | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ1 | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIU | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PKL | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 3D57 | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ2 | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2QPY | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ0 | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NUO | 0.72 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 2PIN | 0.72 |