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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01362320

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
UN3(2-METHYL-5-PHENYL-2H-PYRAZOL-3-
YL)-SULFAMIC ACID
A2F6W0.7
5803-(4-FLUOROPHENYL)-2-(6-METHYLPYRIDIN-
2-YL)-5,6-DIHYDRO-4H-PYRROLO[1,2-
B]PYRAZOLE
A1RW80.73
ZZA1-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACIDA,B,D2VCW0.73
VC33-(4-nitrophenyl)-1H-pyrazoleA,B,C,D2VCZ0.79
DMZ4-METHYL-N-METHYL-N-(2-PHENYL-2H-
PYRAZOL-3-YL)BENZENESULFONAMIDE
A1N6B0.73
LIG3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-
.C.]PYRAZOLE
P1JVP0.74
CEL4-[5-(4-METHYLPHENYL)-3-(TRIFLUOROMETHYL)-
1H-PYRAZOL-1-YL]BENZENESULFONAMIDE
A1OQ50.73
PY14-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-
YL)QUINOLINE
A1PY50.75
MTWHYDROXY(OXO)(3-{[(2Z)-4-[3-(1H-
1,2,4-TRIAZOL-1-YLMETHYL)PHENYL]PYRIMIDIN-
2(5H)-YLIDENE]AMINO}PHENYL)AMMONIUM
A,C2C5X0.74
MTWHYDROXY(OXO)(3-{[(2Z)-4-[3-(1H-
1,2,4-TRIAZOL-1-YLMETHYL)PHENYL]PYRIMIDIN-
2(5H)-YLIDENE]AMINO}PHENYL)AMMONIUM
A2C5Y0.74
5NI5-NITROINDAZOLEA,B1M8I0.73
5NI5-NITROINDAZOLEA,B1M9Q0.73
6NI6-NITROINDAZOLEA,B1M8H0.74
6NI6-NITROINDAZOLEA,B1M9M0.74
GVG3-METHYL-4-PHENYL-1H-PYRAZOLEA2UW30.7
7I27-NITROINDAZOLE-2-CARBOXAMIDINEA,B1FOJ0.78
GG54-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-
4-YL]PYRIDINE
A3HVC0.77
NPMN-[(1E)-PYRIDIN-2-YLMETHYLENE]-
N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE
A,B2ET00.75
LL13-pyridin-4-yl-1H-indazoleA3DNE0.76
7NI7-NITROINDAZOLEA,B1M8E0.72
7NI7-NITROINDAZOLEA,B1FOJ0.72
7NI7-NITROINDAZOLEA,B1M9K0.72
SM5(1E)-5-(1-piperidin-4-yl-3-pyridin-
4-yl-1H-pyrazol-4-yl)-2,3-dihydro-
1H-inden-1-one oxime
A,B3D4Q0.78
FPH3-(4-FLUOROPHENYL)-2-PYRIDIN-4-
YL-1H-PYRROLO[3,2-B]PYRIDIN-1-OL
A1OZ10.74