Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01525943
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 |
P10![]() | [1-(3-HYDROXY-2-OXO-1-PHENETHYL- PROPYLCARBAMOYL)2-PHENYL-ETHYL]- CARBAMIC ACID PYRIDIN-4-YLMETHYL ESTER | A | 1ME3 | 0.71 | ![]() |
368![]() | (1R)-2-{[AMINO(IMINO)METHYL]AMINO}- 1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE | A | 1ZLR | 0.74 | ![]() |
NNR![]() | Nicotinamide riboside | A | 2QT0 | 0.71 | ![]() |
NNR![]() | Nicotinamide riboside | A | 2QT1 | 0.71 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.7 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.7 | ![]() |
D1G![]() | N,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDU | 0.71 | ![]() |
BIN![]() | 2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM | A | 1C8L | 0.71 | ![]() |
BIN![]() | 2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM | A | 2AMV | 0.71 | ![]() |
BIN![]() | 2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM | A | 3AMV | 0.71 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A,B | 2QTN | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4F | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4L | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A,B,C,D | 1YUM | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4M | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A,B,C,D,E,F | 1QPN | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A,B,C | 2B7Q | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4K | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4G | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1YTK | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4H | 0.72 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L5O | 0.72 | ![]() |
INP![]() | 4-[[N-[(PHENYLMETHOXY)CARBONYL]- /NL/N-LEUCYL]AMINO]-1[(2S)-2-[[[4- (PYRIDINYLMETHOXY)CARBONYL]AMINO]- 4-METHYLPENT/NYL]-3-PYRROLIDINONE/N | A | 1AU4 | 0.7 | ![]() |
897![]() | N-[3-(TERT-BUTYLAMINO)-3-OXOPROPYL]- N-ISOPROPYL-3-METHYL-5-{[(2S)-2- (PYRIDIN-4-YLAMINO)PROPYL]OXY}BENZAMIDE | B,H | 2UUK | 0.7 | ![]() |
L11![]() | N-[4-CHLORO-3-(PYRIDIN-3-YLOXYMETHYL)- PHENYL]-3-FLUORO- | A | 1W83 | 0.7 | ![]() |
8ST![]() | N-(4-chlorophenyl)-2-[(pyridin- 4-ylmethyl)amino]benzamide | A | 3HNG | 0.7 | ![]() |
NTM![]() | QUINOLINIC ACID | A | 3C2O | 0.72 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B | 1QAP | 0.72 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.72 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C | 2B7N | 0.72 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHQ | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5L | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2F7F | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5K | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHY | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1FSL | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5M | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1LH6 | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHO | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 3CI8 | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICU | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHA | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHV | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L4N | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2LH6 | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1D0V | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICV | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1ICR | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHR | 0.76 | ![]() |
GPI![]() | (2S)-[3-PYRIDYL-1-PROPYL]-1-[3,3- DIMETHYL-1,2-DIOXOPENTYL]-2-PYRROLIDINECARBOXYLATE | A | 1F40 | 0.74 | ![]() |
225![]() | FELODIPINE | A | 2NNJ | 0.71 | ![]() |
NA4![]() | 4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID | A,C | 1RHM | 0.71 | ![]() |
896![]() | N-ETHYL-N-ISOPROPYL-3-METHYL-5- {[(2S)-2-(PYRIDIN-4-YLAMINO)PROPYL]OXY}BENZAMIDE | B,H | 2UUJ | 0.71 | ![]() |