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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02210705

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
5B25-phenyl-1H-indazol-3-amineA3E630.74
GVG3-METHYL-4-PHENYL-1H-PYRAZOLEA2UW30.84
GVP4-(4-CHLOROPHENYL)-4-[4-(1H-PYRAZOL-
4-YL)PHENYL]PIPERIDINE
A2UW90.72
GVP4-(4-CHLOROPHENYL)-4-[4-(1H-PYRAZOL-
4-YL)PHENYL]PIPERIDINE
A2UW70.72
6NI6-NITROINDAZOLEA,B1M8H0.86
6NI6-NITROINDAZOLEA,B1M9M0.86
PY14-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-
YL)QUINOLINE
A1PY50.73
L152-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINEA2UW40.84
LL13-pyridin-4-yl-1H-indazoleA3DNE0.73
GVN(2R)-2-(4-CHLOROPHENYL)-2-[4-(1H-
PYRAZOL-4-YL)PHENYL]ETHANAMINE
A2UW50.76
R204-(3-METHYLPHENYL)-1H-1,2,3-TRIAZOLEA2ADU0.76
7I27-NITROINDAZOLE-2-CARBOXAMIDINEA,B1FOJ0.7
7NI7-NITROINDAZOLEA,B1M8E0.82
7NI7-NITROINDAZOLEA,B1FOJ0.82
7NI7-NITROINDAZOLEA,B1M9K0.82
5NI5-NITROINDAZOLEA,B1M8I0.87
5NI5-NITROINDAZOLEA,B1M9Q0.87
LZ11H-indazoleA,B3E6I0.8
LZ11H-indazoleA2VTA0.8
MQ0(3-AMINOMETHYL-CINNOLIN-4-YL)-(3,3-
DIPHENYL-ALLYLIDENE)-AMINE
A,B,C3STD0.72
LZ9{[(2,6-difluorophenyl)carbonyl]amino}-
N-(4-fluorophenyl)-1H-pyrazole-
3-carboxamide
A2VTP0.7
L024-[3-(4-CHLOROPHENYL)-1H-PYRAZOL-
5-YL]PIPERIDINE
B,I1WAY0.72
SM5(1E)-5-(1-piperidin-4-yl-3-pyridin-
4-yl-1H-pyrazol-4-yl)-2,3-dihydro-
1H-inden-1-one oxime
A,B3D4Q0.7
VC33-(4-nitrophenyl)-1H-pyrazoleA,B,C,D2VCZ0.93
GVO(2S)-2-(4-CHLOROPHENYL)-2-[4-(1H-
PYRAZOL-4-YL)PHENYL]ETHANAMINE
A2UW60.76
INE3-BROMO-7-NITROINDAZOLEA,B1D0O0.72
INE3-BROMO-7-NITROINDAZOLEA,B1M9R0.72
INE3-BROMO-7-NITROINDAZOLEA,B1D0C0.72
INE3-BROMO-7-NITROINDAZOLEA,B1M9T0.72
INE3-BROMO-7-NITROINDAZOLEA,B1OM50.72
LIG3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-
.C.]PYRAZOLE
P1JVP0.71
GG54-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-
4-YL]PYRIDINE
A3HVC0.75