Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01402310
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 |
BTS | 3-(2-BENZOTHIAZOLYLTHIO)-1-PROPANESULFONIC ACID | A,B | 1SUX | 0.75 | |
SRS | 4-METHYL-3-(9-OXO-1,8-DIAZA-TRICYCLO[10.6.1.0(13,18)]NONADECA- 12(19),13(18),15,17-TETRAENE-10- CARBAMOYL)PENTA-METHYLSULFONEDIIMINE | A | 1MMR | 0.72 | |
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 | 0.72 | |
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 | 0.72 | |
165 | N-(BENZYLSULFONYL)-3-CYCLOHEXYLALANYL- N-(2-AMINO-1,3-BENZOTHIAZOL-6-YL)PROLINAMIDE | H,I | 1SB1 | 0.76 | |
47D | {3-[(5-CHLORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN- 1(2H)-YL}ACETIC ACID | A | 2PDH | 0.76 | |
47D | {3-[(5-CHLORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN- 1(2H)-YL}ACETIC ACID | A | 2PDN | 0.76 | |
47D | {3-[(5-CHLORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN- 1(2H)-YL}ACETIC ACID | A | 2PDG | 0.76 | |
47D | {3-[(5-CHLORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN- 1(2H)-YL}ACETIC ACID | A | 2PDQ | 0.76 | |
THZ | BENZOTHIAZOLE | H,I,R | 1TBZ | 0.76 | |
THZ | BENZOTHIAZOLE | H,I,R | 1B5G | 0.76 | |
RWJ | CYCLOPENTANECARBOXYLIC ACID [1- (BENZOTHIAZOLE-2-CARBONYL)-4-GUANIDINO- BUTYL]-AMIDE | A | 1QCP | 0.85 | |
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 | 0.72 | |
ABB | (2S,4R)-1-ACETYL-N-[(1S)-4-[(AMINOIMINOMETHYL)AMINO]- 1-(2-BENZOTHIAZOLYLCARBONYL)BUTYL]- 4-HYDROXY-2-PYRROLIDINECARBOXAMIDE | A | 1NC6 | 0.82 | |
MZ7 | N~2~-ACETYL-N-{(1S,2R)-3-[(1,3- BENZOTHIAZOL-6-YLSULFONYL)(PENTYL)AMINO]- 1-BENZYL-2-HYDROXYPROPYL}-L-VALINAMIDE | A,B | 2QI5 | 0.74 | |
MZ5 | (2S)-N-[(1S,2R)-3-{(1,3-BENZOTHIAZOL- 6-YLSULFONYL)[(2S)-2-METHYLBUTYL]AMINO}- 1-BENZYL-2-HYDROXYPROPYL]-2-HYDROXY- 3-METHYLBUTANAMIDE | A,B | 2QI3 | 0.71 |