Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02122401
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 |
4BG | N-[4-(benzyloxy)phenyl]glycinamide | A | 3CHO | 0.7 |  |
CRK | 4-{(Z)-[2-[3-(METHYLSULFANYL)PROPANOYL]- 5-OXO-1-(2-OXOETHYL)-1,5-DIHYDRO- 4H-IMIDAZOL-4-YLIDENE]METHYL}BENZENOLATE | A,B | 1XMZ | 0.72 | |
HA2 | 6-[{(2S)-2-AMINO-3-[4-(BENZYLOXY)PHENYL]PROPYL}(HYDROXY)AMINO]- 6-OXOHEXANOIC ACID) | A | 2VJ8 | 0.7 | |
11N | 1-[1'-(3-phenylacryloyl)spiro[1- benzofuran-3,4'-piperidin]-5-yl]methanamine | A,B,C,D | 2ZEC | 0.72 | |
3AC | (2E)-3-{3-[(5-ETHYL-3-IODO-6-METHYL- 2-OXO-1,2-DIHYDROPYRIDIN-4-YL)OXY]PHENYL}ACRYLONITRILE | A | 2B5J | 0.74 | |
DRR | A,B | 3BXR | 0.72 | | |
SPI | N-HYDROXY-1-(4-METHOXYPHENYL)SULFONYL- 4-BENZYLOXYCARBONYL-PIPERAZINE- 2-CARBOXAMIDE | A,B | 1D8F | 0.72 | |
DRS | (9S,12S)-9-(1-methylethyl)-7,10- dioxo-2-oxa-8,11-diazabicyclo[12.2.2]octadeca- 1(16),14,17-triene-12-carboxylic acid | A,B | 3BXS | 0.7 | |
ABY | N-(4-AMINOBUTANOYL)-S-(4-METHOXYBENZYL)- L-CYSTEINYLGLYCINE | A,B | 1PL2 | 0.73 | |
| ABY | N-(4-AMINOBUTANOYL)-S-(4-METHOXYBENZYL)- L-CYSTEINYLGLYCINE | A,B | 1PL1 | 0.73 | |
L05 | 1-BENZYL-3-(4-METHOXYPHENYLAMINO)- 4-PHENYLPYRROLE-2,5-DIONE | A,B,C,D,E,F, G,H | 2ACL | 0.73 | |
CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQJ | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQ3 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQL | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DPZ | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQO | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQ9 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQ4 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQF | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQ6 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQC | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQD | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 1F09 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DPW | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQ1 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQ5 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 1F0B | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQK | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 1MYW | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQN | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 2YFP | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQ8 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DPX | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQE | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQI | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQ7 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQU | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,C,D | 2DD9 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQ2 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQH | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQA | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A | 3DQM | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B | 2DD7 | 0.71 | |
| CR2 | {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]- 5-oxo-4,5-dihydro-1H-imidazol-1- yl}acetic acid | A,B,C,D,E,F | 2G3O | 0.71 | |
SAG | (S)-(+)-2-[4-(FLUOROBENZYLOXY-BENZYLAMINO)PROPIONAMIDE] | A,B | 2V5Z | 0.71 | |
Y12 | 4-{(1E)-3-OXO-3-[(2-PHENYLETHYL)AMINO]PROP- 1-EN-1-YL}-1,2-PHENYLENE DIACETATE | A | 2EW5 | 0.72 | |
CTX | (Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)- PHENOXY]-N,N-DIMETHYLETHANAMINE | A,B,C | 1YA4 | 0.7 | |
CQR | [(4Z)-2-(AMINOMETHYL)-4-(4-HYDROXYBENZYLIDENE)- 5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-1- YL]ACETIC ACID | A,B,C,D | 2G6Y | 0.71 | |
| CQR | [(4Z)-2-(AMINOMETHYL)-4-(4-HYDROXYBENZYLIDENE)- 5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-1- YL]ACETIC ACID | A,B,C,D | 2G6X | 0.71 | |
LZP | 4,4'-piperazine-1,4-diylbis{1-[3- (benzyloxy)phenyl]-4-oxobutane- 1,3-dione} | A | 3EAX | 0.72 | |
4MP | 1-(4-METHOXYBENZOYL)-2-PYRROLIDINONE | A,B | 2AL5 | 0.73 | |
HTA | N-[3-(N'-HYDROXYCARBOXAMIDO)-2- (2-METHYLPROPYL)-PROPANOYL]-O-TYROSINE- N-METHYLAMIDE | A | 1FBL | 0.75 | |
CH7 | [(4Z)-4-(4-HYDROXYBENZYLIDENE)- 5-OXO-2-(3,4,5,6-TETRAHYDROPYRIDIN- 2-YL)-4,5-DIHYDRO-1H-IMIDAZOL-1- YL]ACETIC ACID | A,B | 1XAE | 0.71 | |
| CH7 | [(4Z)-4-(4-HYDROXYBENZYLIDENE)- 5-OXO-2-(3,4,5,6-TETRAHYDROPYRIDIN- 2-YL)-4,5-DIHYDRO-1H-IMIDAZOL-1- YL]ACETIC ACID | A,B,C,D | 2OGR | 0.71 | |
PI4 | 1-[2-(8-CARBAMOYLMETHYL-6,9-DIOXO- 2-OXA-7,10-DIAZA-BICYCLO[11.2.2]HEPTADECA- 1(16),13(17),14-TRIEN-11-YL)-2- HYDROXY-ETHYL]-PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1B6L | 0.72 | |
XYG | [(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4- HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO- 1H-IMIDAZOL-1-YL]ACETIC ACID | A,B | 2PXW | 0.71 | |
| XYG | [(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4- HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO- 1H-IMIDAZOL-1-YL]ACETIC ACID | A,B,C,D | 2FL1 | 0.71 | |
| XYG | [(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4- HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO- 1H-IMIDAZOL-1-YL]ACETIC ACID | A,B | 2PXS | 0.71 | |
| XYG | [(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4- HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO- 1H-IMIDAZOL-1-YL]ACETIC ACID | A,B,C,D | 2ICR | 0.71 | |
F1I | N-[1-(2,6-dimethoxybenzyl)piperidin- 4-yl]-4-sulfanylbutanamide | A | 2ZJI | 0.7 | |