Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02647750
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 |
D25![]() | 3-phenyl-5-(1H-pyrazol-3-yl)isoxazole | A,B,C,D | 2VCQ | 0.72 | ![]() |
5NI![]() | 5-NITROINDAZOLE | A,B | 1M8I | 0.78 | ![]() |
5NI![]() | 5-NITROINDAZOLE | A,B | 1M9Q | 0.78 | ![]() |
NOW![]() | Nalpha-[(3-tert-butyl-1-methyl- 1H-pyrazol-5-yl)carbonyl]-N-[(2Z)- 2-iminoethyl]-3-methyl-L-phenylalaninamide | A,B,C,D | 3HHA | 0.73 | ![]() |
6NI![]() | 6-NITROINDAZOLE | A,B | 1M8H | 0.78 | ![]() |
6NI![]() | 6-NITROINDAZOLE | A,B | 1M9M | 0.78 | ![]() |
LZA![]() | {[(2,6-difluorophenyl)carbonyl]amino}- N-piperidin-4-yl-1H-pyrazole-3- carboxamide | A | 2VTQ | 0.73 | ![]() |
LZ5![]() | N-phenyl-1H-pyrazole-3-carboxamide | A | 2VTL | 0.77 | ![]() |
LZ8![]() | (4E)-N-(4-fluorophenyl)-4-[(phenylcarbonyl)imino]- 4H-pyrazole-3-carboxamide | A | 2VTO | 0.71 | ![]() |
LZD![]() | 4-{[(2,6-difluorophenyl)carbonyl]amino}- N-[(3S)-piperidin-3-yl]-1H-pyrazole- 3-carboxamide | A | 2VTT | 0.73 | ![]() |
LZ1![]() | 1H-indazole | A,B | 3E6I | 0.72 | ![]() |
LZ1![]() | 1H-indazole | A | 2VTA | 0.72 | ![]() |
VC3![]() | 3-(4-nitrophenyl)-1H-pyrazole | A,B,C,D | 2VCZ | 0.8 | ![]() |
INE![]() | 3-BROMO-7-NITROINDAZOLE | A,B | 1D0O | 0.71 | ![]() |
INE![]() | 3-BROMO-7-NITROINDAZOLE | A,B | 1M9R | 0.71 | ![]() |
INE![]() | 3-BROMO-7-NITROINDAZOLE | A,B | 1D0C | 0.71 | ![]() |
INE![]() | 3-BROMO-7-NITROINDAZOLE | A,B | 1M9T | 0.71 | ![]() |
INE![]() | 3-BROMO-7-NITROINDAZOLE | A,B | 1OM5 | 0.71 | ![]() |
LZ3![]() | N-(4-sulfamoylphenyl)-1H-indazole- 3-carboxamide | A | 2VTI | 0.72 | ![]() |
537![]() | 2,6-DIHYDROANTHRA/1,9-CD/PYRAZOL- 6-ONE | A | 1UKI | 0.74 | ![]() |
537![]() | 2,6-DIHYDROANTHRA/1,9-CD/PYRAZOL- 6-ONE | A | 1PMV | 0.74 | ![]() |
537![]() | 2,6-DIHYDROANTHRA/1,9-CD/PYRAZOL- 6-ONE | A | 2ZMD | 0.74 | ![]() |
L15![]() | 2-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINE | A | 2UW4 | 0.71 | ![]() |
7NI![]() | 7-NITROINDAZOLE | A,B | 1M8E | 0.75 | ![]() |
7NI![]() | 7-NITROINDAZOLE | A,B | 1FOJ | 0.75 | ![]() |
7NI![]() | 7-NITROINDAZOLE | A,B | 1M9K | 0.75 | ![]() |
LZ9![]() | {[(2,6-difluorophenyl)carbonyl]amino}- N-(4-fluorophenyl)-1H-pyrazole- 3-carboxamide | A | 2VTP | 0.75 | ![]() |
GVG![]() | 3-METHYL-4-PHENYL-1H-PYRAZOLE | A | 2UW3 | 0.71 | ![]() |
LZ7![]() | 4-(acetylamino)-N-(4-fluorophenyl)- 1H-pyrazole-3-carboxamide | A | 2VTN | 0.74 | ![]() |
582![]() | 5-ETHYL-3-METHYL-1,5-DIHYDRO-4H- PYRAZOLO[4,3-C]QUINOLIN-4-ONE | A | 2QHN | 0.71 | ![]() |