Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01264742
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 |
62A | 2-(5-AMINO-6-OXO-2-M-TOLYL-6H-PYRIMIDIN- 1-YL)-N-[4-GUANIDINO-1-(THIAZOLE- 2-CARBONYL)-BUTYL]-ACETAMIDE | A | 1ZTK | 0.75 | |
632 | 2-(5-BENZYLAMINO-2-METHYLSULFANYL- 6-OXO-6H-PYRIMIDIN-1-YL)-N-[4-GUANIDINO- 1-(THIAZOLE-2-CARBONYL)-BUTYL]- ACETAMIDE | A | 1ZTJ | 0.75 | |
165 | N-(BENZYLSULFONYL)-3-CYCLOHEXYLALANYL- N-(2-AMINO-1,3-BENZOTHIAZOL-6-YL)PROLINAMIDE | H,I | 1SB1 | 0.76 | |
624 | 2-(2-(3,4-DICHLOROPHENYL)-5-(ISOPROPYLAMINO)- 6-OXOPYRIMIDIN-1(6H)-YL)-N-((S)- 1-OXO-1-(THIAZOL-2-YL)-5-GUANIDINOPENTAN- 2-YL)ACETAMIDE | A | 1ZSL | 0.7 | |
RWJ | CYCLOPENTANECARBOXYLIC ACID [1- (BENZOTHIAZOLE-2-CARBONYL)-4-GUANIDINO- BUTYL]-AMIDE | A | 1QCP | 0.75 | |
339 | (S)-2-(3-((R)-1-(4-BROMOPHENYL)ETHYL)UREIDO)- N-((S)-1-((S)-5-GUANIDINO-1-OXO- 1-(THIAZOL-2-YL)PENTAN-2-YLAMINO)- 3-METHYL-1-OXOBUTAN-2-YL)-5-UREIDOPENTANAMIDE | A | 1ZOM | 0.74 | |
D92 | N-((1R,2S)-2-(5-CHLORO-1H-INDOLE- 2-CARBOXAMIDO)CYCLOHEXYL)-5-METHYL- 4,5,6,7-TETRAHYDROTHIAZOLO[5,4- C]PYRIDINE-2-CARBOXAMIDE | A | 2EI6 | 0.71 | |
RIT | RITONAVIR | A,B | 2B60 | 0.71 | |
RIT | RITONAVIR | B,D | 1N49 | 0.71 | |
RIT | RITONAVIR | A | 1RL8 | 0.71 | |
RIT | RITONAVIR | B | 1SH9 | 0.71 | |
RIT | RITONAVIR | B | 1HXW | 0.71 | |
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 | 0.75 | |
DT8 | N-((1R,2S,5S)-2-(5-CHLORO-1H-INDOLE- 2-CARBOXAMIDO)-5-(DIMETHYLCARBAMOYL)CYCLOHEXYL)- 5-METHYL-4,5,6,7-TETRAHYDROTHIAZOLO[5,4- C]PYRIDINE-2-CARBOXAMIDE | A | 2EI8 | 0.71 | |
OIS | (S)-N-((2S,3R)-3-HYDROXY-4-(4-((E)- (HYDROXYIMINO)METHYL)-N-ISOBUTYLPHENYLSULFONAMIDO)- 1-PHENYLBUTAN-2-YL)-3-METHYL-2- (3-((2-METHYLTHIAZOL-4-YL)METHYL)- 2-OXOIMIDAZOLIDIN-1-YL)BUTANAMIDE | A | 1YT9 | 0.77 | |
IN6 | N-[2-[1-(N-BENZYLOXYCARBONYLAMINO)- 3-METHYLBUTYL]THIAZOL-4-YLCARBONYL]- N'-(BENZYLOXYCARBONYL-L-LEUCINYL)HYDRAZIDE | A | 1AYV | 0.7 | |
D93 | N-((1R,2R)-2-(5-CHLORO-1H-INDOLE- 2-CARBOXAMIDO)CYCLOHEXYL)-5-METHYL- 4,5,6,7-TETRAHYDROTHIAZOLO[5,4- C]PYRIDINE-2-CARBOXAMIDE | A | 2EI7 | 0.71 |