Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03696290
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 |
ABY![]() | N-(4-AMINOBUTANOYL)-S-(4-METHOXYBENZYL)- L-CYSTEINYLGLYCINE | A,B | 1PL2 | 0.76 | ![]() |
ABY![]() | N-(4-AMINOBUTANOYL)-S-(4-METHOXYBENZYL)- L-CYSTEINYLGLYCINE | A,B | 1PL1 | 0.76 | ![]() |
BBH![]() | 1-BENZYL-3-(4-METHOXY-BENZENESULFONYL)- 6-OXO-HEXAHYDRO-PYRIMIDINE-4-CARBOXYLIC ACID HYDROXYAMIDE | A,B | 1D8M | 0.74 | ![]() |
BBH![]() | 1-BENZYL-3-(4-METHOXY-BENZENESULFONYL)- 6-OXO-HEXAHYDRO-PYRIMIDINE-4-CARBOXYLIC ACID HYDROXYAMIDE | A,B | 1G05 | 0.74 | ![]() |
CCY![]() | 2-(1-AMINO-2-MERCAPTO-ETHYL)-5- (4-HYDROXY-BENZYL)-3-(ETHANOYL)- 3,5-DIHYDRO-IMIDAZOL-4-ONE | A | 1EMK | 0.73 | ![]() |
012![]() | (4S)-N-[(1S,2R)-1-benzyl-3-{[3- (dimethylamino)benzyl]amino}-2- hydroxypropyl]-1-(3-methoxybenzyl)- 2-oxoimidazolidine-4-carboxamide | A,B,C | 3CKP | 0.73 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | B,D | 2A54 | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3E5V | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | B,D | 2A56 | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | B,D | 2A53 | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | B,D | 2A50 | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,G,H | 3CFH | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,C,D | 3E5W | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,C,D,E,F, G,H | 3BXC | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,G,H | 3CFF | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3E5T | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,C,D,E,F, G,H | 3BXB | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | B,D | 2A52 | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B | 2QLG | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B | 3BXA | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,C,D,E,F, G,H | 2V4E | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B | 2QLI | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B | 1UIS | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,C,D,E,F, G,H | 1ZGQ | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,G,H | 3CFA | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B | 2QLH | 0.72 | ![]() |
NRQ![]() | {(4Z)-4-(4-hydroxybenzylidene)- 2-[3-(methylthio)propanimidoyl]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B | 3BX9 | 0.72 | ![]() |
CH6![]() | {(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]- 4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 2H5Q | 0.72 | ![]() |
CH6![]() | {(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]- 4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 1XQM | 0.72 | ![]() |
CH6![]() | {(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]- 4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B | 2QLG | 0.72 | ![]() |
CH6![]() | {(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]- 4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 1XA9 | 0.72 | ![]() |
GNQ![]() | N-[(1R)-1-[(BENZYLSULFONYL)METHYL]- 2-{[(1S)-1-METHYL-2-{[4-(TRIFLUOROMETHOXY)PHENYL]AMINO}ETHYL]AMINO}- 2-OXOETHYL]MORPHOLINE-4-CARBOXAMIDE | A,B | 2HHN | 0.72 | ![]() |
GNQ![]() | N-[(1R)-1-[(BENZYLSULFONYL)METHYL]- 2-{[(1S)-1-METHYL-2-{[4-(TRIFLUOROMETHOXY)PHENYL]AMINO}ETHYL]AMINO}- 2-OXOETHYL]MORPHOLINE-4-CARBOXAMIDE | A,B | 2HH5 | 0.72 | ![]() |
L05![]() | 1-BENZYL-3-(4-METHOXYPHENYLAMINO)- 4-PHENYLPYRROLE-2,5-DIONE | A,B,C,D,E,F, G,H | 2ACL | 0.72 | ![]() |
LIJ![]() | BENZYL [(1S)-2-({(1S,2R)-1-BENZYL- 2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}AMINO)- 2-OXO-1-{[(1-PROPYLBUTYL)SULFONYL]METHYL}ETHYL]CARBAMATE | A,B,C | 2HIZ | 0.72 | ![]() |
401![]() | (2S)-2-{3-[({[2-fluoro-4-(trifluoromethyl)phenyl]carbonyl}amino)methyl]- 4-methoxybenzyl}butanoic acid | A,B | 2ZNQ | 0.71 | ![]() |
Y12![]() | 4-{(1E)-3-OXO-3-[(2-PHENYLETHYL)AMINO]PROP- 1-EN-1-YL}-1,2-PHENYLENE DIACETATE | A | 2EW5 | 0.71 | ![]() |
331![]() | (2S)-2-(4-[2-(3-[2,4-DIFLUOROPHENYL]- 1-HEPTYLUREIDO)ETHYL]PHENOXY)-2- METHYLBUTYRIC ACID | A,B | 1Y0S | 0.71 | ![]() |
MC1![]() | METHICILLIN ACYL-SERINE | A,B | 1MWU | 0.71 | ![]() |
HA2![]() | 6-[{(2S)-2-AMINO-3-[4-(BENZYLOXY)PHENYL]PROPYL}(HYDROXY)AMINO]- 6-OXOHEXANOIC ACID) | A | 2VJ8 | 0.71 | ![]() |
T1D![]() | 5-(4-METHOXYBIPHENYL-3-YL)-1,2,5- THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE | A | 2BGD | 0.71 | ![]() |
ZYA![]() | BENZOYL-TYROSINE-ALANINE-METHYL KETONE | A | 1AIM | 0.7 | ![]() |
SP6![]() | BENZYL 6-BENZYL-5,7-DIOXO-6,7-DIHYDRO- 5H-[1,3]THIAZOLO[3,2-C]PYRIMIDINE- 2-CARBOXYLATE | A,B | 2OW9 | 0.7 | ![]() |
CJO![]() | [(2R,4R)-2-[(1R,2R)-1-amino-2-hydroxypropyl]- 4-(4-hydroxybenzyl)-5-oxoimidazolidin- 1-yl]acetic acid | A | 2QT2 | 0.7 | ![]() |
AXL![]() | 2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)- ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL- THIAZOLIDINE-4-CARBOXYLIC ACID | B | 1LL9 | 0.7 | ![]() |
4BO![]() | (3S)-3-amino-4-oxo-4-[(4-phenylmethoxyphenyl)amino]butanoic acid | A | 3CHP | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A,B | 2AH8 | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A,B,C,D | 1HCJ | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A,B,C,D | 1W7S | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A,B,C,D | 1W7T | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A,B | 2AHA | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A | 1EME | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A,B | 1KP5 | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A | 1EMM | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A | 1EML | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A,B,C,D | 1W7U | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A,B,C,D | 1EMC | 0.7 | ![]() |
CSY![]() | [4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY- 1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN- 1-YL]-ACETIC ACID | A | 2HPW | 0.7 | ![]() |
INZ![]() | 2-{4-[(2S)-2-[({[(1S)-1-CARBOXY- 2-PHENYLETHYL]AMINO}CARBONYL)AMINO]- 3-OXO-3-(PENTYLAMINO)PROPYL]PHENOXY}MALONIC ACID | A | 1G7F | 0.7 | ![]() |
F1I![]() | N-[1-(2,6-dimethoxybenzyl)piperidin- 4-yl]-4-sulfanylbutanamide | A | 2ZJI | 0.7 | ![]() |