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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03250955

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
NAS2-NAPHTHALENESULFONIC ACIDI1QUR0.86
NAS2-NAPHTHALENESULFONIC ACIDE,I1PPC0.86
NAS2-NAPHTHALENESULFONIC ACIDH1ETS0.86
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.74
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.74
MAJindane-5-sulfonamideA2QOA0.74
BZBBENZO[B]THIOPHENE-2-BORONIC ACIDA,B3FKV0.7
BZBBENZO[B]THIOPHENE-2-BORONIC ACIDA,B1C3B0.7
OXEORTHO-XYLENEA,B3E0X0.7
OXEORTHO-XYLENEA188L0.7
SMLPHENYL METHYL SULFONEA,I1D6W0.73
SMLPHENYL METHYL SULFONEA,I1D9I0.73
PVS(ethenylsulfonyl)benzeneA3BLU0.72
TLD4-methylbenzene-1,2-dithiolA2Z940.72
NPYNAPHTHALENEA,B1O7G0.78
TOSP-SULFINOTOLUENEH1ETT0.74
TOSP-SULFINOTOLUENEI4PAD0.74
TOSP-SULFINOTOLUENEA1EST0.74
TOSP-SULFINOTOLUENEC,G2CHA0.74
TOSP-SULFINOTOLUENEE1PPH0.74
PEYPHENANTHRENEA,B2HML0.72
PEYPHENANTHRENEA,B2HMK0.72
BPSA,B2DE40.77
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.84
NTSNAPHTHALENE TRISULFONATEA1RML0.82
PCB4,4'-BIS([H]METHYLSULFONYL)-2,2',5,5'-
TETRACHLOROBIPHENYL
A1UTR0.71
AN3ANTHRACENEA,B2HMN0.72
AN3ANTHRACENEA,B2HMM0.72
TSUPARA-TOLUENE SULFONATEA,B1WUW0.73
TSUPARA-TOLUENE SULFONATEA1B0D0.73