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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01641434

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LZ3N-(4-sulfamoylphenyl)-1H-indazole-
3-carboxamide
A2VTI0.73
5NI5-NITROINDAZOLEA,B1M8I0.78
5NI5-NITROINDAZOLEA,B1M9Q0.78
LL13-pyridin-4-yl-1H-indazoleA3DNE0.74
R204-(3-METHYLPHENYL)-1H-1,2,3-TRIAZOLEA2ADU0.71
DMZ4-METHYL-N-METHYL-N-(2-PHENYL-2H-
PYRAZOL-3-YL)BENZENESULFONAMIDE
A1N6B0.72
CEL4-[5-(4-METHYLPHENYL)-3-(TRIFLUOROMETHYL)-
1H-PYRAZOL-1-YL]BENZENESULFONAMIDE
A1OQ50.72
LZ11H-indazoleA,B3E6I0.82
LZ11H-indazoleA2VTA0.82
SBC1-[4-(AMINOSULFONYL)PHENYL]-1,6-
DIHYDROPYRAZOLO[3,4-E]INDAZOLE-
3-CARBOXAMIDE
A,C,D2BKZ0.78
L152-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINEA2UW40.76
GVG3-METHYL-4-PHENYL-1H-PYRAZOLEA2UW30.76
7NI7-NITROINDAZOLEA,B1M8E0.75
7NI7-NITROINDAZOLEA,B1FOJ0.75
7NI7-NITROINDAZOLEA,B1M9K0.75
5B34-(3-amino-1H-indazol-5-yl)-N-tert-
butylbenzenesulfonamide
A3E640.85
6NI6-NITROINDAZOLEA,B1M8H0.8
6NI6-NITROINDAZOLEA,B1M9M0.8
VC33-(4-nitrophenyl)-1H-pyrazoleA,B,C,D2VCZ0.75
5B25-phenyl-1H-indazol-3-amineA3E630.76