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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00005824

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
G142-phenyl-1H-imidazole-4-carboxylic acidA,B3GRJ0.71
PHN1,10-PHENANTHROLINEA1LIH0.73
PHN1,10-PHENANTHROLINEA2LIG0.73
PHN1,10-PHENANTHROLINEA,B2FU70.73
DPT4,7-DIMETHYL-[1,10]PHENANTHROLINEA,B1I530.72
PD2PYRIDINE-2,4-DICARBOXYLIC ACIDA,B,C2W2I0.7
PD2PYRIDINE-2,4-DICARBOXYLIC ACIDA2GKL0.7
PD2PYRIDINE-2,4-DICARBOXYLIC ACIDA,B2VD70.7
PD2PYRIDINE-2,4-DICARBOXYLIC ACIDA,B2JIG0.7
ZZA1-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACIDA,B,D2VCW0.7
APY2-AMINOMETHYL-PYRIDINEA,B,I1HIV0.7
APY2-AMINOMETHYL-PYRIDINEI1IVP0.7
CNQ3-(4-CHLOROPHENYL)QUINOXALINE-5-
CARBOXAMIDE
A,B,C,D1WOK0.71
NTMQUINOLINIC ACIDA3C2O0.73
NTMQUINOLINIC ACIDA,B1QAP0.73
NTMQUINOLINIC ACIDA,B,C,D,E,F1QPQ0.73
NTMQUINOLINIC ACIDA,B,C2B7N0.73
2755-amino-1,2-dimethylpyridiniumX2RBW0.71
QUI2-CARBOXYQUINOXALINEA1PFE0.97
QUI2-CARBOXYQUINOXALINEA,B2DA80.97
QUI2-CARBOXYQUINOXALINEA,C,E,G2ADW0.97
QUI2-CARBOXYQUINOXALINEA1VS20.97
QUI2-CARBOXYQUINOXALINEA1XVN0.97
QUI2-CARBOXYQUINOXALINEA,B185D0.97
QUI2-CARBOXYQUINOXALINEA1XVK0.97
QUI2-CARBOXYQUINOXALINEA,C1XVR0.97
QUI2-CARBOXYQUINOXALINEA,B3GO30.97
QMSN-(QUINOLIN-8-YL)METHANESULFONAMIDEA2BB70.71
34Q(3R,4R)-4-(pyrrolidin-1-ylcarbonyl)-
1-(quinoxalin-2-ylcarbonyl)pyrrolidin-
3-amine
A2RIP0.78
6PCPYRIDINE-2-CARBOXYLIC ACIDA2OLN0.76
6PCPYRIDINE-2-CARBOXYLIC ACIDA2OLO0.76
QYT(5E)-5-(QUINOXALIN-6-YLMETHYLENE)-
1,3-THIAZOLIDINE-2,4-DIONE
A2A5U0.73
PYA3-(1,10-PHENANTHROL-2-YL)-L-ALANINEA1HCW0.72