Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01361246
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 |
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 | 0.73 | ![]() |
43B![]() | 3-NITRO-N-{4-[2-(2-PHENYLETHYL)- 1,3-BENZOTHIAZOL-5-YL]BENZOYL}- 4-{[2-(PHENYLSULFANYL)ETHYL]AMINO}BENZENESULFONAMIDE | A | 2O21 | 0.71 | ![]() |
43B![]() | 3-NITRO-N-{4-[2-(2-PHENYLETHYL)- 1,3-BENZOTHIAZOL-5-YL]BENZOYL}- 4-{[2-(PHENYLSULFANYL)ETHYL]AMINO}BENZENESULFONAMIDE | A | 2O1Y | 0.71 | ![]() |
43B![]() | 3-NITRO-N-{4-[2-(2-PHENYLETHYL)- 1,3-BENZOTHIAZOL-5-YL]BENZOYL}- 4-{[2-(PHENYLSULFANYL)ETHYL]AMINO}BENZENESULFONAMIDE | A | 1YSN | 0.71 | ![]() |
43B![]() | 3-NITRO-N-{4-[2-(2-PHENYLETHYL)- 1,3-BENZOTHIAZOL-5-YL]BENZOYL}- 4-{[2-(PHENYLSULFANYL)ETHYL]AMINO}BENZENESULFONAMIDE | A | 1YSW | 0.71 | ![]() |
MHC![]() | 3-MERCAPTO-1-(1,3,4,9-TETRAHYDRO- B-CARBOLIN-2-YL)-PROPAN-1-ONE | A | 1NBP | 0.72 | ![]() |
AK1![]() | 1-{5-[2-(thieno[3,2-d]pyrimidin- 4-ylamino)ethyl]-1,3-thiazol-2- yl}-3-[3-(trifluoromethyl)phenyl]urea | A | 3D14 | 0.7 | ![]() |
LS2![]() | N-METHYL-{4-[2-(7-OXO-6,7-DIHYDRO- 8H-[1,3]THIAZOLO[5,4-E]INDOL-8- YLIDENE)HYDRAZINO]PHENYL}METHANESULFONAMIDE | A | 1KE6 | 0.73 | ![]() |
ABB![]() | (2S,4R)-1-ACETYL-N-[(1S)-4-[(AMINOIMINOMETHYL)AMINO]- 1-(2-BENZOTHIAZOLYLCARBONYL)BUTYL]- 4-HYDROXY-2-PYRROLIDINECARBOXAMIDE | A | 1NC6 | 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 | 0.75 | ![]() |
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 | 0.73 | ![]() |
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 | 0.73 | ![]() |
K88![]() | (3Z)-N,N-DIMETHYL-2-OXO-3-(4,5,6,7- TETRAHYDRO-1H-INDOL-2-YLMETHYLIDENE)- 2,3-DIHYDRO-1H-INDOLE-5-SULFONAMIDE | A,D | 2WEL | 0.7 | ![]() |
F32![]() | (5S)-5-{4-[(2S)-2-(1H-BENZIMIDAZOL- 2-YL)-2-(1,3-BENZOTHIAZOL-2-YLAMINO)ETHYL]PHENYL}ISOTHIAZOLIDIN- 3-ONE 1,1-DIOXIDE | A | 2CNF | 0.71 | ![]() |
3NA![]() | {3-[(4,5,7-TRIFLUORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-1H-INDOL-1-YL}ACETIC ACID | A | 1Z3N | 0.72 | ![]() |
D76![]() | (2R)-4-[(6-CHLORO-2-NAPHTHYL)SULFONYL]- 1-[(5-METHYL-4,5,6,7-TETRAHYDRO[1,3]THIAZOLO[5,4- C]PYRIDIN-2-YL)CARBONYL]PIPERAZINE- 2-CARBOXAMIDE | A | 1V3X | 0.71 | ![]() |
CM6![]() | (2S)-2-[(2,1,3-BENZOTHIADIAZOL- 4-YLSULFONYL)AMINO]-2-PHENYL-N- PYRIDIN-4-YLACETAMIDE | A | 2CIB | 0.7 | ![]() |
47D![]() | {3-[(5-CHLORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN- 1(2H)-YL}ACETIC ACID | A | 2PDH | 0.7 | ![]() |
47D![]() | {3-[(5-CHLORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN- 1(2H)-YL}ACETIC ACID | A | 2PDN | 0.7 | ![]() |
47D![]() | {3-[(5-CHLORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN- 1(2H)-YL}ACETIC ACID | A | 2PDG | 0.7 | ![]() |
47D![]() | {3-[(5-CHLORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN- 1(2H)-YL}ACETIC ACID | A | 2PDQ | 0.7 | ![]() |
JN5![]() | (2S)-1,3-benzothiazol-2-yl{2-[(2- pyridin-3-ylethyl)amino]pyrimidin- 4-yl}ethanenitrile | A | 3CY3 | 0.71 | ![]() |
737![]() | N-[4-GUANIDINO-1-(THIAZOLE-2-CARBONYL)- BUTYL]-2-{6-OXO-5-[(QUINOLIN-8- YLMETHYL)-AMINO]-2-M-TOLYL-6H-PYRIMIDIN- 1-YL}-ACETAMIDE | A | 1ZTL | 0.71 | ![]() |
AR2![]() | ARGINYL-BENZOTHIAZOLE-6-CARBOXYLIC ACID | A,B,I | 1DOJ | 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 | 0.7 | ![]() |
165![]() | N-(BENZYLSULFONYL)-3-CYCLOHEXYLALANYL- N-(2-AMINO-1,3-BENZOTHIAZOL-6-YL)PROLINAMIDE | H,I | 1SB1 | 0.77 | ![]() |