Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01717867
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 |
TEI![]() | 2-(3-CYANO-4-ISOBUTOXY-PHENYL)- 4-METHYL-5-THIAZOLE-CARBOXYLIC ACID | A,B | 1N5X | 0.71 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.73 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHQ | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5L | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2F7F | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5K | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHY | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1FSL | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5M | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1LH6 | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHO | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 3CI8 | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICU | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHA | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHV | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L4N | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2LH6 | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1D0V | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICV | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1ICR | 0.73 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHR | 0.73 | ![]() |
WAY![]() | N-HYDROXY-2-[(4-METHOXY-BENZENESULFONYL)- PYRIDIN-3-YLMETHYL-AMINO]-3-METHYL- BENZAMIDE | A | 1FLS | 0.76 | ![]() |
WAY![]() | N-HYDROXY-2-[(4-METHOXY-BENZENESULFONYL)- PYRIDIN-3-YLMETHYL-AMINO]-3-METHYL- BENZAMIDE | A | 1FM1 | 0.76 | ![]() |
BT1![]() | {2-[4-(2-PYRROLIDIN-1-YL-ETHOXY)- PHENYL]-BENZO[B]THIOPHEN-3-YL}- [4-(2-PYRROLIDIN-1-YL-ETHOXY)-PHENYL]- METHANONE | B,H | 1D3T | 0.76 | ![]() |
BI5![]() | 4-PHENOXY-N-(PYRIDIN-2-YLMETHYL)BENZAMIDE | A | 1ZYJ | 0.77 | ![]() |
D3G![]() | (5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE | A,B,C,D | 2FDW | 0.76 | ![]() |
D1G![]() | N,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDU | 0.76 | ![]() |
735![]() | 2-METHYL-2-(4-{[({4-METHYL-2-[4- (TRIFLUOROMETHYL)PHENYL]-1,3-THIAZOL- 5-YL}CARBONYL)AMINO]METHYL}PHENOXY)PROPANOIC ACID | A | 2P54 | 0.7 | ![]() |
POS![]() | 1-[[(4-PHENOXYPHENYL)SULFONYL]AMINO]- 3-[[N/N-(4-PYRIDINYLCARBONYL)-L- LEUCYL]AMINO]-2-PROPANOL | A | 1AU2 | 0.72 | ![]() |
BQN![]() | 4-{(2E)-3-[4-{[2-(pyridin-3-ylmethoxy)phenyl]sulfanyl}- 2,3-bis(trifluoromethyl)phenyl]prop- 2-enoyl}morpholine | B,C | 3BQN | 0.76 | ![]() |
PIX![]() | 4-(3-{[5-(trifluoromethyl)pyridin- 2-yl]oxy}benzyl)piperidine-1-carboxylic acid | A,B | 2WAP | 0.71 | ![]() |
982![]() | 3-(CARBOXYMETHOXY)THIENO[2,3-B]PYRIDINE- 2-CARBOXYLIC ACID | A | 2AZR | 0.76 | ![]() |
KIN![]() | 1-[4-(PYRIDIN-4-YLOXY)PHENYL]-3- [3-(TRIFLUOROMETHYL)PHENYL]UREA | A | 2HZN | 0.7 | ![]() |
D2G![]() | N-METHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDV | 0.75 | ![]() |
608![]() | N-(4-phenoxyphenyl)-2-[(pyridin- 4-ylmethyl)amino]nicotinamide | A,B | 2P2I | 0.74 | ![]() |
CGS![]() | N-HYDROXY-2(R)-[[(4-METHOXYPHENYL)SULFONYL](3- PICOLYL)AMINO]-3-METHYLBUTANAMIDE HYDROCHLORIDE | A,B,C,D | 2W0D | 0.7 | ![]() |
CGS![]() | N-HYDROXY-2(R)-[[(4-METHOXYPHENYL)SULFONYL](3- PICOLYL)AMINO]-3-METHYLBUTANAMIDE HYDROCHLORIDE | A | 3AYK | 0.7 | ![]() |
CGS![]() | N-HYDROXY-2(R)-[[(4-METHOXYPHENYL)SULFONYL](3- PICOLYL)AMINO]-3-METHYLBUTANAMIDE HYDROCHLORIDE | A,B | 1JIZ | 0.7 | ![]() |
CGS![]() | N-HYDROXY-2(R)-[[(4-METHOXYPHENYL)SULFONYL](3- PICOLYL)AMINO]-3-METHYLBUTANAMIDE HYDROCHLORIDE | A | 4AYK | 0.7 | ![]() |