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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00010421

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TSM2-HYDROSULFONYL-2-METHYLPROPANEA,B1OD10.75
TSM2-HYDROSULFONYL-2-METHYLPROPANEE1EPR0.75
TSM2-HYDROSULFONYL-2-METHYLPROPANEA,B2JJJ0.75
TSM2-HYDROSULFONYL-2-METHYLPROPANEA,B2JJI0.75
TSM2-HYDROSULFONYL-2-METHYLPROPANEA,B2VS20.75
ESAETHANESULFONIC ACIDA2H0Y0.87
ESAETHANESULFONIC ACIDA,B,C,D,E,F1RDF0.87
ESAETHANESULFONIC ACIDA1F9P0.87
1DB1-DECANE-SULFONIC-ACIDA,Z2CFU0.79
HDS1-HEXADECANOSULFONIC ACIDC,D1QD60.74
HDS1-HEXADECANOSULFONIC ACIDA1QZ30.74
HDS1-HEXADECANOSULFONIC ACIDA1LIC0.74
HDS1-HEXADECANOSULFONIC ACIDA1LPP0.74
HDS1-HEXADECANOSULFONIC ACIDA1EXW0.74
HDS1-HEXADECANOSULFONIC ACIDA1LPO0.74
DSCDODECANESULFONATE IONA1LPN0.72
COM1-THIOETHANESULFONIC ACIDA,C,D,F1MRO0.76
COM1-THIOETHANESULFONIC ACIDA,B,C,D,E,F1HBO0.76
COM1-THIOETHANESULFONIC ACIDA,B,C,D,E,F1HBN0.76
COM1-THIOETHANESULFONIC ACIDA,B,C,D,E,F1HBU0.76
COM1-THIOETHANESULFONIC ACIDA,C,D,F1E6Y0.76
COM1-THIOETHANESULFONIC ACIDA,B2C3D0.76
COM1-THIOETHANESULFONIC ACIDA,D1E6V0.76
COM1-THIOETHANESULFONIC ACIDA,B2C3C0.76