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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00006698

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LZ5N-phenyl-1H-pyrazole-3-carboxamideA2VTL0.7
6NI6-NITROINDAZOLEA,B1M8H0.91
6NI6-NITROINDAZOLEA,B1M9M0.91
PY14-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-
YL)QUINOLINE
A1PY50.74
MQ0(3-AMINOMETHYL-CINNOLIN-4-YL)-(3,3-
DIPHENYL-ALLYLIDENE)-AMINE
A,B,C3STD0.71
LIG3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-
.C.]PYRAZOLE
P1JVP0.73
5NI5-NITROINDAZOLEA,B1M8I0.91
5NI5-NITROINDAZOLEA,B1M9Q0.91
R204-(3-METHYLPHENYL)-1H-1,2,3-TRIAZOLEA2ADU0.79
L152-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINEA2UW40.86
TSH2-(1H-INDOL-3-YL)ETHANIMINED,H2AGY0.71
TSH2-(1H-INDOL-3-YL)ETHANIMINED,H2AH00.71
TSH2-(1H-INDOL-3-YL)ETHANIMINED,H2AGX0.71
GVG3-METHYL-4-PHENYL-1H-PYRAZOLEA2UW30.86
5372,6-DIHYDROANTHRA/1,9-CD/PYRAZOL-
6-ONE
A1UKI0.73
5372,6-DIHYDROANTHRA/1,9-CD/PYRAZOL-
6-ONE
A1PMV0.73
5372,6-DIHYDROANTHRA/1,9-CD/PYRAZOL-
6-ONE
A2ZMD0.73
GVO(2S)-2-(4-CHLOROPHENYL)-2-[4-(1H-
PYRAZOL-4-YL)PHENYL]ETHANAMINE
A2UW60.72
LZ11H-indazoleA,B3E6I1
LZ11H-indazoleA2VTA1
5B34-(3-amino-1H-indazol-5-yl)-N-tert-
butylbenzenesulfonamide
A3E640.7
5B15-bromo-1H-indazol-3-amineA3E620.8
7NI7-NITROINDAZOLEA,B1M8E0.86
7NI7-NITROINDAZOLEA,B1FOJ0.86
7NI7-NITROINDAZOLEA,B1M9K0.86
INE3-BROMO-7-NITROINDAZOLEA,B1D0O0.75
INE3-BROMO-7-NITROINDAZOLEA,B1M9R0.75
INE3-BROMO-7-NITROINDAZOLEA,B1D0C0.75
INE3-BROMO-7-NITROINDAZOLEA,B1M9T0.75
INE3-BROMO-7-NITROINDAZOLEA,B1OM50.75
5B25-phenyl-1H-indazol-3-amineA3E630.81
7I27-NITROINDAZOLE-2-CARBOXAMIDINEA,B1FOJ0.71
LL13-pyridin-4-yl-1H-indazoleA3DNE0.82
TSS2-(1H-INDOL-3-YL)ETHANAMINEA,B,D,H2IUQ0.71
TSS2-(1H-INDOL-3-YL)ETHANAMINEA,B2FPB0.71
TSS2-(1H-INDOL-3-YL)ETHANAMINED,H2AGW0.71
TSS2-(1H-INDOL-3-YL)ETHANAMINEA2PQL0.71
GVN(2R)-2-(4-CHLOROPHENYL)-2-[4-(1H-
PYRAZOL-4-YL)PHENYL]ETHANAMINE
A2UW50.72
VC33-(4-nitrophenyl)-1H-pyrazoleA,B,C,D2VCZ0.85
L024-[3-(4-CHLOROPHENYL)-1H-PYRAZOL-
5-YL]PIPERIDINE
B,I1WAY0.73
GG54-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-
4-YL]PYRIDINE
A3HVC0.75
INDINDOLEA1L4H0.71
INDINDOLEA,B,G1O7N0.71
INDINDOLEA185L0.71
INDINDOLEA,B1EG90.71
INDINDOLEA,B1UUV0.71
INDINDOLEA,C,E2B240.71
INDINDOLEA,B,C,D,E,F2P850.71