Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02372652
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 |
7IG | 5-{4-[(3,5-DIFLUOROBENZYL)AMINO]PHENYL}- 6-ETHYLPYRIMIDINE-2,4-DIAMINE | A | 2IKO | 0.71 | |
7IG | 5-{4-[(3,5-DIFLUOROBENZYL)AMINO]PHENYL}- 6-ETHYLPYRIMIDINE-2,4-DIAMINE | A | 2G24 | 0.71 | |
2AQ | QUINOLIN-2-AMINE | A | 2OHL | 0.7 | |
P5C | 2-{[(1R,2S)-2-aminocyclohexyl]amino}- 4-[(3-methylphenyl)amino]pyrimidine- 5-carboxamide | A | 3FQE | 0.72 | |
FTB | N-{4-[1-(2-FLUOROBENZYL)-3-BUTYL- 2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H- PURIN-8-YLMETHYL]-PHENYL}-ACETAMIDE | A | 1NHX | 0.75 | |
OQB | 4-OXO-3-[(6-{[4-(QUINOXALIN-2-YLAMINO)- BENZOYLAMINO]-METHYL}-PYRIDINE- 3-CARBONYL)-AMINO]-BUTYRIC ACID | A | 1RWW | 0.75 | |
C24 | 3-({2-[(4-CARBAMIMIDOYL-PHENYLAMINO)- METHYL]-3-METHYL-3H-BENZOIMIDAZOLE- 5-CARBONYL}-PYRIDIN-2-YL-AMINO)- PROPIONIC ACID ETHYL ESTER | B,C | 1KTS | 0.7 | |
AM9 | 6-(2,6-dimethylphenyl)-2-{[4-(4- methylpiperazin-1-yl)phenyl]amino}pyrimido[5',4':5,6]pyrimido[1,2- a]benzimidazol-5(6H)-one | A | 3BYO | 0.7 | |
8AP | N~3~-BENZYLPYRIDINE-2,3-DIAMINE | A | 2OHM | 0.71 | |
NAZ | N~3~-{3-[(7-METHYL-1,8-NAPHTHYRIDIN- 2-YL)AMINO]-3-OXOPROPYL}-N~1~-[(7- OXO-7,8-DIHYDRO-1,8-NAPHTHYRIDIN- 2-YL)METHYL]-BETA-ALANINAMIDE | A,B | 1X26 | 0.7 | |
4QB | 3-{2-ETHYL-6-[4-(QUINOXALIN-2-YLAMINO)- BENZOYLAMINO]-HEXANOYLAMINO}-4- OXO-BUTYRIC ACID | A | 1RWN | 0.75 | |
CY0 | S-{3-[(4-ANILINOQUINAZOLIN-6-YL)AMINO]- 3-OXOPROPYL}-L-CYSTEINE | A | 2J5E | 0.72 | |
FOL | FOLIC ACID | A | 1PJ6 | 0.72 | |
FOL | FOLIC ACID | A,B | 1RD7 | 0.72 | |
FOL | FOLIC ACID | A,B | 1DHF | 0.72 | |
FOL | FOLIC ACID | A,B,C,D,E | 1QZF | 0.72 | |
FOL | FOLIC ACID | A | 4CD2 | 0.72 | |
FOL | FOLIC ACID | A | 1RX7 | 0.72 | |
FOL | FOLIC ACID | A | 1RX2 | 0.72 | |
FOL | FOLIC ACID | A | 1RX8 | 0.72 | |
FOL | FOLIC ACID | A | 1RA2 | 0.72 | |
FOL | FOLIC ACID | A,B | 1RE7 | 0.72 | |
FOL | FOLIC ACID | A | 7DFR | 0.72 | |
FOL | FOLIC ACID | A | 1VIF | 0.72 | |
FOL | FOLIC ACID | A,B | 1RB2 | 0.72 | |
FOL | FOLIC ACID | A | 1CD2 | 0.72 | |
FOL | FOLIC ACID | A | 2CD2 | 0.72 | |
FOL | FOLIC ACID | A,B | 1DYI | 0.72 | |
FOL | FOLIC ACID | A | 1DRF | 0.72 | |
FOL | FOLIC ACID | A,B,C,D | 3BMC | 0.72 | |
FOL | FOLIC ACID | A,B | 2D0K | 0.72 | |
FOL | FOLIC ACID | A | 1RA8 | 0.72 | |
G14 | 2-phenyl-1H-imidazole-4-carboxylic acid | A,B | 3GRJ | 0.77 | |
985 | (2E)-3-{3-[6-(4-methyl-1,4-diazepan- 1-yl)pyrazin-2-yl]phenyl}prop-2- enoic acid | A | 3F2A | 0.71 | |
55F | N-[4-(5-fluoro-6-methylpyridin- 2-yl)-5-quinoxalin-6-yl-1H-imidazol- 2-yl]acetamide | A,B,C,D,E | 3FAA | 0.71 | |
356 | 8-[(3R)-3-Aminopiperidin-1-yl]- 7-but-2-yn-1-yl-3-methyl-1-[(4- methylquinazolin-2-yl)methyl]-3,7- dihydro-1H-purine-2,6-dione | A,B | 2RGU | 0.72 | |
LUM | LUMICHROME | A | 2CC6 | 0.79 | |
LUM | LUMICHROME | A,B | 1S4M | 0.79 | |
LUM | LUMICHROME | A | 2CC7 | 0.79 | |
LUM | LUMICHROME | A | 1HE5 | 0.79 | |
DX2 | 6-phenylpteridine-2,4,7-triamine | A,B,C,D | 3BME | 0.7 | |
NFL | 2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID | A | 1TD7 | 0.72 | |
PB3 | N,N'-BIS(3-METHYLBENZYL)PYRIMIDINE- 4,6-DICARBOXAMIDE | A,B | 1XUC | 0.7 |