Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00497322
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 |
TFL![]() | 2-[4-(DIMETHYLAMINO)PHENYL]-6-HYDROXY- 3-METHYL-1,3-BENZOTHIAZOL-3-IUM | A | 2J3Q | 0.76 | ![]() |
3NA![]() | {3-[(4,5,7-TRIFLUORO-1,3-BENZOTHIAZOL- 2-YL)METHYL]-1H-INDOL-1-YL}ACETIC ACID | A | 1Z3N | 0.73 | ![]() |
22M![]() | 2-(2-METHYLPHENYL)-1H-INDOLE-6- CARBOXIMIDAMIDE | A | 2G5V | 0.71 | ![]() |
P83![]() | 1-(9-ethyl-9H-carbazol-3-yl)-N- methylmethanamine | A,B | 2VUK | 0.7 | ![]() |
TH1![]() | 2-(BETA-D-GLUCOPYRANOSYL)-5-METHYL- BENZOTHIAZOLE | A | 1XL1 | 0.74 | ![]() |
BTS![]() | 3-(2-BENZOTHIAZOLYLTHIO)-1-PROPANESULFONIC ACID | A,B | 1SUX | 0.77 | ![]() |
TOT![]() | 1,1-(4,4,8,8-TETRAMETHYL-4,8-DIAZAUNDECAMETHYLENE)- BIS-4-3-METHYL-2,3-DIHYDRO-(BENZO- 1,3-THIAZOLE)-2-METHYLIDENE)-QUINOLINIUM | A | 108D | 0.71 | ![]() |
THZ![]() | BENZOTHIAZOLE | H,I,R | 1TBZ | 0.79 | ![]() |
THZ![]() | BENZOTHIAZOLE | H,I,R | 1B5G | 0.79 | ![]() |
2MI![]() | 2-METHYL-1H-INDOLE | A | 2PIO | 0.71 | ![]() |
9CA![]() | 9H-CARBAZOLE | A,B,C,D,E,F | 2DE7 | 0.71 | ![]() |
D1B![]() | 2-(5-{4-[AMINO(IMINO)METHYL]PHENYL}- 2-THIENYL)-1H-BENZIMIDAZOLE-6- CARBOXIMIDAMIDE DIHYDROCHLORIDE | A | 1VZK | 0.72 | ![]() |
ESP![]() | THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE | B | 1C5Y | 0.72 | ![]() |
ESP![]() | THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE | A | 1C5U | 0.72 | ![]() |
ESP![]() | THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE | A | 1C5T | 0.72 | ![]() |
P90![]() | {4-[(2S,4E)-2-(1,3-BENZOTHIAZOL- 2-YL)-2-(1H-1,2,3-BENZOTRIAZOL- 1-YL)-5-PHENYLPENT-4-ENYL]PHENYL}(DIFLUORO)METHYLPHOSPHONIC ACID | A,B | 1Q6N | 0.77 | ![]() |