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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03525176

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
XY2N,N'-DIMETHYL-N-(ACETYL)-N'-(7-
NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE
X2CL70.72
XY2N,N'-DIMETHYL-N-(ACETYL)-N'-(7-
NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE
X2CL60.72
XY2N,N'-DIMETHYL-N-(ACETYL)-N'-(7-
NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE
X2CE20.72
XY2N,N'-DIMETHYL-N-(ACETYL)-N'-(7-
NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE
X2EVW0.72
XY2N,N'-DIMETHYL-N-(ACETYL)-N'-(7-
NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE
X2CL00.72
XY2N,N'-DIMETHYL-N-(ACETYL)-N'-(7-
NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE
X2CLC0.72
LZ11H-indazoleA,B3E6I0.74
LZ11H-indazoleA2VTA0.74
VC33-(4-nitrophenyl)-1H-pyrazoleA,B,C,D2VCZ0.76
7I27-NITROINDAZOLE-2-CARBOXAMIDINEA,B1FOJ0.89
INE3-BROMO-7-NITROINDAZOLEA,B1D0O0.76
INE3-BROMO-7-NITROINDAZOLEA,B1M9R0.76
INE3-BROMO-7-NITROINDAZOLEA,B1D0C0.76
INE3-BROMO-7-NITROINDAZOLEA,B1M9T0.76
INE3-BROMO-7-NITROINDAZOLEA,B1OM50.76
LL13-pyridin-4-yl-1H-indazoleA3DNE0.74
PY14-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-
YL)QUINOLINE
A1PY50.7
5NI5-NITROINDAZOLEA,B1M8I0.81
5NI5-NITROINDAZOLEA,B1M9Q0.81
FPH3-(4-FLUOROPHENYL)-2-PYRIDIN-4-
YL-1H-PYRROLO[3,2-B]PYRIDIN-1-OL
A1OZ10.72
7NI7-NITROINDAZOLEA,B1M8E0.86
7NI7-NITROINDAZOLEA,B1FOJ0.86
7NI7-NITROINDAZOLEA,B1M9K0.86
6NI6-NITROINDAZOLEA,B1M8H0.8
6NI6-NITROINDAZOLEA,B1M9M0.8
3B3(2S)-1-AMINO-3-[(5-NITROQUINOLIN-
8-YL)AMINO]PROPAN-2-OL
A2CGV0.7