Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00671154
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 |
846 | [4R--(1ALPHA,5ALPHA,7BETA)]-3-[(CYCLOPROPHYLMETHYL)HEXAHYDRO- 5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)- 1H-1,3-DIAZEPIN]METHYL-2-THIAZOLYLBENZAMIDE | B | 1QBU | 0.78 | |
HM5 | 3-[(2,2-DIMETHYLPROPANOYL)AMINO]- N-1,3-THIAZOL-2-YLPYRIDINE-2-CARBOXAMIDE | A | 2NQ7 | 0.72 | |
LS4 | 4-{[(2-OXO-1,2-DIHYDRO-3H-INDOL- 3-YLIDENE)METHYL]AMINO}-N-(1,3- THIAZOL-2-YL)BENZENESULFONAMIDE | A | 1KE8 | 0.76 | |
D28 | 4-{[4-(4-fluoro-3-methylphenyl)- 1,3-thiazol-2-yl]amino}-2-hydroxybenzoic acid | A,B,C,D | 2VD1 | 0.7 | |
MRK | 2-AMINO-4-FLUORO-5-[(1-METHYL-1H- IMIDAZOL-2-YL)SULFANYL]-N-(1,3- THIAZOL-2-YL)BENZAMIDE | A | 3F9M | 0.72 | |
MRK | 2-AMINO-4-FLUORO-5-[(1-METHYL-1H- IMIDAZOL-2-YL)SULFANYL]-N-(1,3- THIAZOL-2-YL)BENZAMIDE | A | 1V4S | 0.72 | |
B18 | (4R)-N-[4-({[2-(DIMETHYLAMINO)ETHYL]AMINO}CARBONYL)- 1,3-THIAZOL-2-YL]-4-METHYL-1-OXO- 2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE- 6-CARBOXAMIDE | A,B,C | 2PZY | 0.71 | |
LOI | 2-(methylamino)-N-(4-methyl-1,3- thiazol-2-yl)-5-[(4-methyl-4H-1,2,4- triazol-3-yl)sulfanyl]benzamide | A | 3GOI | 0.71 | |
S91 | [4-({5-(AMINOCARBONYL)-4-[(3-METHYLPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENYL]ACETIC ACID | A | 2Z8C | 0.7 | |
S91 | [4-({5-(AMINOCARBONYL)-4-[(3-METHYLPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENYL]ACETIC ACID | A | 2Z7L | 0.7 | |
698 | (2S,4S,5R)-1-(4-TERT-BUTYLBENZOYL)- 2-ISOBUTYL-5-(1,3-THIAZOL-2-YL)PYRROLIDINE- 2,4-DICARBOXYLIC ACID | A,B | 2JC1 | 0.73 | |
DZF | 5-DEAZAFOLIC ACID | A,B | 2DHF | 0.7 | |
DZF | 5-DEAZAFOLIC ACID | A,B | 1DYH | 0.7 | |
DZF | 5-DEAZAFOLIC ACID | A,B,C,D | 1CDE | 0.7 | |
304 | N-[2-methyl-5-(methylcarbamoyl)phenyl]- 2-{[(1R)-1-methylpropyl]amino}- 1,3-thiazole-5-carboxamide | A | 3BX5 | 0.79 | |
PF3 | (2R)-3-({[4-[(PYRIDIN-4-YL)PHENYL]- THIEN-2-YL}CARBOXAMIDO)(PHENYL)PROPANOIC ACID | A,B | 1UTZ | 0.74 | |
AD6 | 4-[(5-bromo-1,3-thiazol-2-yl)amino]- N-methylbenzamide | A,B | 2VGP | 0.81 | |
HM4 | TERT-BUTYL {2-[(1,3-THIAZOL-2-YLAMINO)CARBONYL]PYRIDIN- 3-YL}CARBAMATE | A | 2NQ6 | 0.72 | |
XV6 | A | 1BV9 | 0.76 | ||
XV6 | B | 1BWA | 0.76 | ||
XV6 | A | 1BV7 | 0.76 | ||
XV6 | A | 1QBR | 0.76 | ||
Q2Y | 4-OXO-3-[2-(5-{[4-(QUINOXALIN-2- YLAMINO)-BENZOYLAMINO]-METHYL}- THIOPHEN-2-YL)-ACETYLAMINO]-PENTANOIC ACID | A | 1RWM | 0.74 | |
685 | 2-{2-[(3,5-dimethylphenyl)amino]pyrimidin- 4-yl}-N-[(1S)-2-hydroxy-1-methylethyl]- 4-methyl-1,3-thiazole-5-carboxamide | A | 3EMG | 0.7 | |
BTH | 4-OXO-3-{6-[4-(QUINOXALIN-2-YLAMINO)- BENZOYLAMINO]-2-THIOPHEN-2-YL-HEXANOYLAMINO}- PENTANOIC ACID | A | 1RWO | 0.76 |