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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02187006

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.73
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.73
PBCPHENYL BORONIC ACIDA2A320.7
PBCPHENYL BORONIC ACIDA1JU30.7
TSUPARA-TOLUENE SULFONATEA,B1WUW0.76
TSUPARA-TOLUENE SULFONATEA1B0D0.76
BNSHYDROSULFONYLBENZENE11YYY0.76
BNSHYDROSULFONYLBENZENEA1MEM0.76
BNSHYDROSULFONYLBENZENEA,D,E1FH00.76
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.76
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.75
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.79
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.79
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.79
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.79
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.79
TLD4-methylbenzene-1,2-dithiolA2Z940.7
BPSA,B2DE40.71
SMLPHENYL METHYL SULFONEA,I1D6W0.84
SMLPHENYL METHYL SULFONEA,I1D9I0.84
BT6benzenethiolA,B,C,D3HSR0.77
PVS(ethenylsulfonyl)benzeneA3BLU0.83
TOSP-SULFINOTOLUENEH1ETT0.77
TOSP-SULFINOTOLUENEI4PAD0.77
TOSP-SULFINOTOLUENEA1EST0.77
TOSP-SULFINOTOLUENEC,G2CHA0.77
TOSP-SULFINOTOLUENEE1PPH0.77