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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02550275

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.79
PA0Phenylarsine oxideA3E3Z0.76
BT6benzenethiolA,B,C,D3HSR0.87
TLD4-methylbenzene-1,2-dithiolA2Z940.7
PBCPHENYL BORONIC ACIDA2A320.73
PBCPHENYL BORONIC ACIDA1JU30.73
PVS(ethenylsulfonyl)benzeneA3BLU0.7
BNSHYDROSULFONYLBENZENE11YYY0.8
BNSHYDROSULFONYLBENZENEA1MEM0.8
BNSHYDROSULFONYLBENZENEA,D,E1FH00.8
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.8
SMLPHENYL METHYL SULFONEA,I1D6W0.71
SMLPHENYL METHYL SULFONEA,I1D9I0.71
BNZBENZENEA1L830.77
BNZBENZENEA1CP40.77
BNZBENZENEA,B,C,D1XXJ0.77
BNZBENZENEB1SWI0.77
BNZBENZENEA181L0.77
BNZBENZENEA223L0.77
BNZBENZENEA3DMX0.77
BNZBENZENEA2Z9G0.77
BNZBENZENEA220L0.77
BNZBENZENEA227L0.77
BNZBENZENEA,B1A7Z0.77
BNZBENZENEA1L840.77
F5B1,2,3,4,5-pentafluorobenzeneA3DN00.85
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.79
HFBhexafluorobenzeneA3DMZ0.73
PIHIODOPHENYLA1UO50.73
PIHIODOPHENYLA3DNA0.73
PIHIODOPHENYLA1F9O0.73
PIHIODOPHENYLA,B1UO40.73
PIHIODOPHENYLA3DN40.73
PHGPHENYLMERCURYA1CZS0.77
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.75
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.75
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.75
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.75
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.75
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.82