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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03842224

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
VC33-(4-nitrophenyl)-1H-pyrazoleA,B,C,D2VCZ0.76
5372,6-DIHYDROANTHRA/1,9-CD/PYRAZOL-
6-ONE
A1UKI0.75
5372,6-DIHYDROANTHRA/1,9-CD/PYRAZOL-
6-ONE
A1PMV0.75
5372,6-DIHYDROANTHRA/1,9-CD/PYRAZOL-
6-ONE
A2ZMD0.75
LZ5N-phenyl-1H-pyrazole-3-carboxamideA2VTL0.73
INE3-BROMO-7-NITROINDAZOLEA,B1D0O0.71
INE3-BROMO-7-NITROINDAZOLEA,B1M9R0.71
INE3-BROMO-7-NITROINDAZOLEA,B1D0C0.71
INE3-BROMO-7-NITROINDAZOLEA,B1M9T0.71
INE3-BROMO-7-NITROINDAZOLEA,B1OM50.71
5NI5-NITROINDAZOLEA,B1M8I0.74
5NI5-NITROINDAZOLEA,B1M9Q0.74
LZ3N-(4-sulfamoylphenyl)-1H-indazole-
3-carboxamide
A2VTI0.72
6NI6-NITROINDAZOLEA,B1M8H0.73
6NI6-NITROINDAZOLEA,B1M9M0.73
LZ74-(acetylamino)-N-(4-fluorophenyl)-
1H-pyrazole-3-carboxamide
A2VTN0.7
7NI7-NITROINDAZOLEA,B1M8E0.72
7NI7-NITROINDAZOLEA,B1FOJ0.72
7NI7-NITROINDAZOLEA,B1M9K0.72
LZ9{[(2,6-difluorophenyl)carbonyl]amino}-
N-(4-fluorophenyl)-1H-pyrazole-
3-carboxamide
A2VTP0.72
NOWNalpha-[(3-tert-butyl-1-methyl-
1H-pyrazol-5-yl)carbonyl]-N-[(2Z)-
2-iminoethyl]-3-methyl-L-phenylalaninamide
A,B,C,D3HHA0.71
N5BN-(5-CYCLOPROPYL-1H-PYRAZOL-3-YL)BENZAMIDEA1VYZ0.72