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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02103104

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HYZN-[1-(3-fluorobenzyl)-1H-indazol-
5-yl]-5-[(piperidin-1-ylamino)methyl]pyrimidine-
4,6-diamine
A2RGP0.73
IDZ3-(1H-BENZIMIDAZOL-2-YL)-1H-INDAZOLEA2C3L0.71
6NI6-NITROINDAZOLEA,B1M8H0.77
6NI6-NITROINDAZOLEA,B1M9M0.77
7I27-NITROINDAZOLE-2-CARBOXAMIDINEA,B1FOJ0.74
FRZ5-(2-PHENYLPYRAZOLO[1,5-A]PYRIDIN-
3-YL)-1H-PYRAZOLO[3,4-C]PYRIDAZIN-
3-AMINE
A1TVO0.7
PY14-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-
YL)QUINOLINE
A1PY50.73
5B25-phenyl-1H-indazol-3-amineA3E630.72
L152-[4-(3-METHYL-1H-PYRAZOL-4-YL)PHENYL]ETHANAMINEA2UW40.78
6IP6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-
2-AMINE
A2OHP0.7
P442-(CYCLOHEXYLMETHYLAMINO)-4-(PHENYLAMINO)PYRAZOLO[1,5-
A][1,3,5]TRIAZINE-8-CARBONITRILE
A2PVJ0.72
L0D2-(1H-pyrazol-3-yl)-1H-benzimidazoleA2W1D0.71
P19N,N'-DIPHENYLPYRAZOLO[1,5-A][1,3,5]TRIAZINE-
2,4-DIAMINE
A2PVH0.72
LL13-pyridin-4-yl-1H-indazoleA3DNE0.79
5NI5-NITROINDAZOLEA,B1M8I0.79
5NI5-NITROINDAZOLEA,B1M9Q0.79
LZ11H-indazoleA,B3E6I0.83
LZ11H-indazoleA2VTA0.83
D26PHENYL-5-(1H-PYRAZOL-3-YL)-1,3-
THIAZOLE
A,B,C,D2VCX0.71
GVG3-METHYL-4-PHENYL-1H-PYRAZOLEA2UW30.76
7NI7-NITROINDAZOLEA,B1M8E0.75
7NI7-NITROINDAZOLEA,B1FOJ0.75
7NI7-NITROINDAZOLEA,B1M9K0.75
LIG3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-
.C.]PYRAZOLE
P1JVP0.71
VC33-(4-nitrophenyl)-1H-pyrazoleA,B,C,D2VCZ0.73
R204-(3-METHYLPHENYL)-1H-1,2,3-TRIAZOLEA2ADU0.7
GG54-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-
4-YL]PYRIDINE
A3HVC0.73
QIGN-1H-indazol-5-yl-2-(6-methylpyridin-
2-yl)quinazolin-4-amine
A3GXL0.76