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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01244341

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.76
NAS2-NAPHTHALENESULFONIC ACIDI1QUR0.77
NAS2-NAPHTHALENESULFONIC ACIDE,I1PPC0.77
NAS2-NAPHTHALENESULFONIC ACIDH1ETS0.77
SMLPHENYL METHYL SULFONEA,I1D6W0.73
SMLPHENYL METHYL SULFONEA,I1D9I0.73
NTSNAPHTHALENE TRISULFONATEA1RML0.74
PVS(ethenylsulfonyl)benzeneA3BLU0.72
BPSA,B2DE40.76
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3B2Q0.72
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4T0.72
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4R0.72
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3EIU0.72
TOSP-SULFINOTOLUENEH1ETT0.74
TOSP-SULFINOTOLUENEI4PAD0.74
TOSP-SULFINOTOLUENEA1EST0.74
TOSP-SULFINOTOLUENEC,G2CHA0.74
TOSP-SULFINOTOLUENEE1PPH0.74
B69A2ZCR0.7
MAJindane-5-sulfonamideA2QOA0.76
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.76
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.76
TSUPARA-TOLUENE SULFONATEA,B1WUW0.75
TSUPARA-TOLUENE SULFONATEA1B0D0.75
PCB4,4'-BIS([H]METHYLSULFONYL)-2,2',5,5'-
TETRACHLOROBIPHENYL
A1UTR0.71
ZYX4-(2-AMINOETHYL)BENZENESULFONAMIDEA2NNG0.71