Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02510192
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 |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.7 | |
FHB | 3-FLUORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCF | 0.7 | |
ZHZ | 2-(4-METHOXYPHENYL)ACETAMIDE | D,H | 2HKR | 0.7 | |
DFL | 2-(4-HYDROXY-PHENYL)-CHROMAN-4- ONE | A,B | 1JEP | 0.71 | |
OX3 | 4-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOH | 0.71 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.74 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.74 | |
FIL | (1E)-1-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]ETHANONE O- (AMINOCARBONYL)OXIME | A,B | 1XLZ | 0.7 | |
U03 | 4-HYDROXY-7-METHOXY-3-(1-PHENYL- PROPYL)-CHROMEN-2-ONE | A | 3UPJ | 0.72 | |
3MB | 3-METHOXYBENZAMIDE | A | 3PAX | 0.71 | |
FLN | 2-PHENYL-4H-CHROMEN-4-ONE | A | 2G0L | 0.72 | |
NRO | 3-[5-(2-nitropent-1-en-1-yl)furan- 2-yl]benzoic acid | A,B | 2ZK5 | 0.74 | |
WRS | 4-HYDROXY-3-[(1S,3S)-3-HYDROXY- 1-PHENYLBUTYL]-2H-CHROMEN-2-ONE | A | 1HA2 | 0.72 | |
HDI | 3-(4-HYDROXYPHENYL)-4,5-DIHYDRO- 5-ISOXAZOLE-ACETIC ACID METHYL ESTER | A,B,C | 1LJT | 0.71 | |
WRR | 4-HYDROXY-3-[(1S,3R)-3-HYDROXY- 1-PHENYLBUTYL]-2H-CHROMEN-2-ONE | A | 1H9Z | 0.72 | |
NCZ | 2-HYDROXY-7-METHOXY-5-METHYL-NAPHTHALENE- 1-CARBOXYLIC ACID MESO-2,5-DIHYDROXY- CYCLOPENT-3-ENYL ESTER | A | 1J5I | 0.72 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.7 | |
NPS | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | A | 2VDB | 0.71 | |
BVL | (2E)-1-[2-hydroxy-4-methoxy-5-(3- methylbut-2-en-1-yl)phenyl]-3-(4- hydroxyphenyl)prop-2-en-1-one | A | 2ZBH | 0.76 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.71 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.71 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.71 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.71 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.71 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.71 | |
GEN | GENISTEIN | A | 1QKM | 0.71 | |
GEN | GENISTEIN | A,B | 1X7J | 0.71 | |
GEN | GENISTEIN | A,B | 2QA8 | 0.71 | |
GEN | GENISTEIN | A | 1X7R | 0.71 | |
R88 | (4-BROMOPHENYL)[4-({(2E)-4-[CYCLOPROPYL(METHYL)AMINO]BUT- 2-ENYL}OXY)PHENYL]METHANONE | A,B,C | 1H36 | 0.71 | |
SAK | (2S)-5-hydroxy-2-(4-hydroxyphenyl)- 7-methoxy-2,3-dihydro-4H-chromen- 4-one | A,B,C,D,E,F | 3D04 | 0.71 | |
VXX | VANILLATE | A,B | 1WB6 | 0.75 | |
L41 | {4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid | A,B | 3D5F | 0.72 | |
MGI | methyl 4-(2,3-dihydroxy-5-methylphenoxy)- 2-hydroxy-6-methylbenzoate | A | 2ZA0 | 0.71 | |
IHB | 3-IODO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCI | 0.7 | |
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 | |
DTC | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A | 2Z9C | 0.73 | |
DTC | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A,B | 1OOQ | 0.73 | |
DTC | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A,B,C,D,E,F, G,H | 2F1O | 0.73 | |
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 | |
DDC | 7-HYDROXY-2-PHENYL-CHROMAN-4-ONE | A,B | 1FM8 | 0.7 | |
HMO | 4'-HYDROXY-7-METHOXYISOFLAVONE | A | 1FP2 | 0.73 | |
AGI | 5,7-dihydroxy-2-(4-hydroxyphenyl)- 4H-chromen-4-one | A,B,C,D,E,F | 3CF9 | 0.7 | |
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 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.74 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.72 | |
FDS | FLUORESCIN | H | 4FAB | 0.7 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.7 | |
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 | 0.71 | |
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 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.72 | |
3A3 | A | 2CGU | 0.72 | ||
IKR | methyl (2E)-{2-[(4-iodo-2,5-dimethylphenoxy)methyl]phenyl}(methoxyimino)ethanoate | A,C,D,E,N,P, Q,R | 3H1K | 0.8 | |
QSO | 5,7-dihydroxy-3-(4-methoxyphenyl)- 4H-chromen-4-one | A,B | 2QYO | 0.73 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ4 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOB | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXB | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1G1B | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1YKJ | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUV | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PBE | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCC | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PDH | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUW | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC4 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC6 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUW | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1FW9 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1G81 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGJ | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUX | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ3 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1D7L | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 2PHH | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGN | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXA | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOC | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1K0I | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BKW | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1JD3 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXC | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1TT8 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ2 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1Q4S | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BF3 | 0.72 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUR | 0.72 | |
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.71 |