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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02828628

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
78P(2R)-2-(7-carbamoyl-1H-benzimidazol-
2-yl)-2-methylpyrrolidinium
A2RD60.7
HP1IMIDAZOLE-PYRROLE-HYDROXYPYRROLE POLYAMIDEA,B407D0.77
I19N-(4-{[(3S)-3-(dimethylamino)pyrrolidin-
1-yl]carbonyl}phenyl)-5-fluoro-
4-[2-methyl-1-(1-methylethyl)-1H-
imidazol-5-yl]pyrimidin-2-amine
A2W170.72
DMYDISTAMYCIN AA217D0.74
DMYDISTAMYCIN AA1K2Z0.74
DMYDISTAMYCIN AA,B,E,F2JT70.74
DMYDISTAMYCIN AA,B267D0.74
DMYDISTAMYCIN AA306D0.74
DMYDISTAMYCIN AA304D0.74
DMYDISTAMYCIN AA305D0.74
DMYDISTAMYCIN AA1JUX0.74
DMYDISTAMYCIN AA2DND0.74
DMYDISTAMYCIN AA,B,C,D378D0.74
DMYDISTAMYCIN AB1JTL0.74
DMYDISTAMYCIN AA159D0.74
DMYDISTAMYCIN AA216D0.74
N31N-[3-(1H-benzimidazol-1-yl)propanoyl]glycyl-
L-alanyl-L-alaninamide
A3EXB0.71
3BA7-amino-2-tert-butyl-4-{[2-(1H-
imidazol-4-yl)ethyl]amino}pyrido[2,3-
d]pyrimidine-6-carboxamide
A3BAA0.73
DBQDEBROMOHYMENIALDISINEA2C3J0.76
DBQDEBROMOHYMENIALDISINEA,B1U4D0.76
DBQDEBROMOHYMENIALDISINEA2CN80.76
DBQDEBROMOHYMENIALDISINEA1Z570.76
IIPIMIDAZOLE-PYRROLE POLYAMIDEA,B365D0.79
FXGN-butyl-3-{[6-(9H-purin-6-ylamino)hexanoyl]amino}benzamideA3DAJ0.7
PB5N,N'-BIS(PYRIDIN-3-YLMETHYL)PYRIMIDINE-
4,6-DICARBOXAMIDE
A,B1XUR0.72
IPYIMIDAZOLE-PYRROLE POLYAMIDEA,B408D0.78
IPYIMIDAZOLE-PYRROLE POLYAMIDEA,B1CVY0.78
P11IMIDAZOLE-PYRROLE-BETA ALANINE-
IMIDAZOLE-BETA ALANINE-IMIDAZOLE-
PYRROLE-BETA ALANINE-DIMETHYLAMINO PROPYLAMIDE
A1LEJ0.77
AIKN-[3-(DIMETHYLAMINO)PROPYL]-2-({[4-
({[4-(FORMYLAMINO)-1-METHYL-1H-
PYRROL-2-YL]CARBONYL}AMINO)-1-METHYL-
1H-PYRROL-2-YL]CARBONYL}AMINO)-
5-ISOPROPYL-1,3-THIAZOLE-4-CARBOXAMIDE
A,B1RMX0.71
553(7S)-2-(2-aminopyrimidin-4-yl)-
7-(2-fluoroethyl)-1,5,6,7-tetrahydro-
4H-pyrrolo[3,2-c]pyridin-4-one
A,B3DU80.71
9HX9-DEAZAHYPOXANTHINEA,B,C1I800.73
CYEB1PQQ0.76
9DG9-DEAZAGUANINEA,B,C,D,E1Q2S0.75
9DG9-DEAZAGUANINEA1IL40.75
9DG9-DEAZAGUANINEA,C1FSG0.75
9DG9-DEAZAGUANINEA,B,C,D1Q2R0.75
ILTMONOIMIDAZOLE LEXITROPSINA1LEY0.85
ILTMONOIMIDAZOLE LEXITROPSINB1LEX0.85