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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02671407

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PBCPHENYL BORONIC ACIDA2A320.72
PBCPHENYL BORONIC ACIDA1JU30.72
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.7
PHGPHENYLMERCURYA1CZS0.75
PIHIODOPHENYLA1UO50.72
PIHIODOPHENYLA3DNA0.72
PIHIODOPHENYLA1F9O0.72
PIHIODOPHENYLA,B1UO40.72
PIHIODOPHENYLA3DN40.72
BNSHYDROSULFONYLBENZENE11YYY0.78
BNSHYDROSULFONYLBENZENEA1MEM0.78
BNSHYDROSULFONYLBENZENEA,D,E1FH00.78
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.78
PA0Phenylarsine oxideA3E3Z0.74
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.73
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.73
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.73
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.73
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.73
TLD4-methylbenzene-1,2-dithiolA2Z940.71
SMLPHENYL METHYL SULFONEA,I1D6W0.8
SMLPHENYL METHYL SULFONEA,I1D9I0.8
BNZBENZENEA1L830.75
BNZBENZENEA1CP40.75
BNZBENZENEA,B,C,D1XXJ0.75
BNZBENZENEB1SWI0.75
BNZBENZENEA181L0.75
BNZBENZENEA223L0.75
BNZBENZENEA3DMX0.75
BNZBENZENEA2Z9G0.75
BNZBENZENEA220L0.75
BNZBENZENEA227L0.75
BNZBENZENEA,B1A7Z0.75
BNZBENZENEA1L840.75
BT6benzenethiolA,B,C,D3HSR0.84
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.71
PVS(ethenylsulfonyl)benzeneA3BLU0.79