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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02400161

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NAS2-NAPHTHALENESULFONIC ACIDI1QUR0.78
NAS2-NAPHTHALENESULFONIC ACIDE,I1PPC0.78
NAS2-NAPHTHALENESULFONIC ACIDH1ETS0.78
BPSA,B2DE40.82
MAJindane-5-sulfonamideA2QOA0.73
B69A2ZCR0.71
NTSNAPHTHALENE TRISULFONATEA1RML0.75
B70tripotassium (1R)-4-biphenyl-4-
yl-1-phosphonatobutane-1-sulfonate
A2ZCS0.72
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.77
TOSP-SULFINOTOLUENEH1ETT0.75
TOSP-SULFINOTOLUENEI4PAD0.75
TOSP-SULFINOTOLUENEA1EST0.75
TOSP-SULFINOTOLUENEC,G2CHA0.75
TOSP-SULFINOTOLUENEE1PPH0.75
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2OUA0.72
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B,C,D2AJC0.72
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B3PRO0.72
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2PFE0.72
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.81
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.81
TSUPARA-TOLUENE SULFONATEA,B1WUW0.74
TSUPARA-TOLUENE SULFONATEA1B0D0.74