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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01973446

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.74
TLD4-methylbenzene-1,2-dithiolA2Z940.74
BPSA,B2DE40.79
SMLPHENYL METHYL SULFONEA,I1D6W0.73
SMLPHENYL METHYL SULFONEA,I1D9I0.73
TOSP-SULFINOTOLUENEH1ETT0.76
TOSP-SULFINOTOLUENEI4PAD0.76
TOSP-SULFINOTOLUENEA1EST0.76
TOSP-SULFINOTOLUENEC,G2CHA0.76
TOSP-SULFINOTOLUENEE1PPH0.76
PVS(ethenylsulfonyl)benzeneA3BLU0.72
OXEORTHO-XYLENEA,B3E0X0.72
OXEORTHO-XYLENEA188L0.72
NTSNAPHTHALENE TRISULFONATEA1RML0.76
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.78
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.74
MAJindane-5-sulfonamideA2QOA0.76
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.76
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.76
NAS2-NAPHTHALENESULFONIC ACIDI1QUR0.8
NAS2-NAPHTHALENESULFONIC ACIDE,I1PPC0.8
NAS2-NAPHTHALENESULFONIC ACIDH1ETS0.8
TSUPARA-TOLUENE SULFONATEA,B1WUW0.75
TSUPARA-TOLUENE SULFONATEA1B0D0.75
BDBA,B1KE30.71
PCB4,4'-BIS([H]METHYLSULFONYL)-2,2',5,5'-
TETRACHLOROBIPHENYL
A1UTR0.71
B70tripotassium (1R)-4-biphenyl-4-
yl-1-phosphonatobutane-1-sulfonate
A2ZCS0.71
B69A2ZCR0.72
NPYNAPHTHALENEA,B1O7G0.71