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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03285607

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GVG3-METHYL-4-PHENYL-1H-PYRAZOLEA2UW30.73
L152-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINEA2UW40.73
5NI5-NITROINDAZOLEA,B1M8I0.77
5NI5-NITROINDAZOLEA,B1M9Q0.77
6NI6-NITROINDAZOLEA,B1M8H0.78
6NI6-NITROINDAZOLEA,B1M9M0.78
GVN(2R)-2-(4-CHLOROPHENYL)-2-[4-(1H-
PYRAZOL-4-YL)PHENYL]ETHANAMINE
A2UW50.76
VC33-(4-nitrophenyl)-1H-pyrazoleA,B,C,D2VCZ0.83
L024-[3-(4-CHLOROPHENYL)-1H-PYRAZOL-
5-YL]PIPERIDINE
B,I1WAY0.82
GVP4-(4-CHLOROPHENYL)-4-[4-(1H-PYRAZOL-
4-YL)PHENYL]PIPERIDINE
A2UW90.71
GVP4-(4-CHLOROPHENYL)-4-[4-(1H-PYRAZOL-
4-YL)PHENYL]PIPERIDINE
A2UW70.71
INE3-BROMO-7-NITROINDAZOLEA,B1D0O0.73
INE3-BROMO-7-NITROINDAZOLEA,B1M9R0.73
INE3-BROMO-7-NITROINDAZOLEA,B1D0C0.73
INE3-BROMO-7-NITROINDAZOLEA,B1M9T0.73
INE3-BROMO-7-NITROINDAZOLEA,B1OM50.73
GVO(2S)-2-(4-CHLOROPHENYL)-2-[4-(1H-
PYRAZOL-4-YL)PHENYL]ETHANAMINE
A2UW60.76
LZ11H-indazoleA,B3E6I0.71
LZ11H-indazoleA2VTA0.71
7NI7-NITROINDAZOLEA,B1M8E0.74
7NI7-NITROINDAZOLEA,B1FOJ0.74
7NI7-NITROINDAZOLEA,B1M9K0.74
5B25-phenyl-1H-indazol-3-amineA3E630.76