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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03400150

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BPSA,B2DE40.83
NPYNAPHTHALENEA,B1O7G0.75
NTSNAPHTHALENE TRISULFONATEA1RML0.85
AN3ANTHRACENEA,B2HMN0.76
AN3ANTHRACENEA,B2HMM0.76
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.78
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.78
MAJindane-5-sulfonamideA2QOA0.72
PEYPHENANTHRENEA,B2HML0.76
PEYPHENANTHRENEA,B2HMK0.76
5NS5-aminonaphthalene-1-sulfonic acidA,B3CFT0.7
NAS2-NAPHTHALENESULFONIC ACIDI1QUR0.87
NAS2-NAPHTHALENESULFONIC ACIDE,I1PPC0.87
NAS2-NAPHTHALENESULFONIC ACIDH1ETS0.87
TOSP-SULFINOTOLUENEH1ETT0.74
TOSP-SULFINOTOLUENEI4PAD0.74
TOSP-SULFINOTOLUENEA1EST0.74
TOSP-SULFINOTOLUENEC,G2CHA0.74
TOSP-SULFINOTOLUENEE1PPH0.74
BDBA,B1KE30.71
TSUPARA-TOLUENE SULFONATEA,B1WUW0.75
TSUPARA-TOLUENE SULFONATEA1B0D0.75
WW7N-(6-AMINOHEXYL)-5-CHLORO-1-NAPHTHALENESULFONAMIDEA1MUX0.71
B70tripotassium (1R)-4-biphenyl-4-
yl-1-phosphonatobutane-1-sulfonate
A2ZCS0.76
B69A2ZCR0.77
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.85