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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02400705

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PHN1,10-PHENANTHROLINEA1LIH0.73
PHN1,10-PHENANTHROLINEA2LIG0.73
PHN1,10-PHENANTHROLINEA,B2FU70.73
QMSN-(QUINOLIN-8-YL)METHANESULFONAMIDEA2BB70.72
DPT4,7-DIMETHYL-[1,10]PHENANTHROLINEA,B1I530.72
6NI6-NITROINDAZOLEA,B1M8H0.72
6NI6-NITROINDAZOLEA,B1M9M0.72
LL13-pyridin-4-yl-1H-indazoleA3DNE0.7
PY14-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-
YL)QUINOLINE
A1PY50.74
5NI5-NITROINDAZOLEA,B1M8I0.74
5NI5-NITROINDAZOLEA,B1M9Q0.74
3B3(2S)-1-AMINO-3-[(5-NITROQUINOLIN-
8-YL)AMINO]PROPAN-2-OL
A2CGV0.77
MQ0(3-AMINOMETHYL-CINNOLIN-4-YL)-(3,3-
DIPHENYL-ALLYLIDENE)-AMINE
A,B,C3STD0.73
7I27-NITROINDAZOLE-2-CARBOXAMIDINEA,B1FOJ0.76
VC33-(4-nitrophenyl)-1H-pyrazoleA,B,C,D2VCZ0.73
7NI7-NITROINDAZOLEA,B1M8E0.74
7NI7-NITROINDAZOLEA,B1FOJ0.74
7NI7-NITROINDAZOLEA,B1M9K0.74