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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00004076

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.78
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.78
PIHIODOPHENYLA1UO50.71
PIHIODOPHENYLA3DNA0.71
PIHIODOPHENYLA1F9O0.71
PIHIODOPHENYLA,B1UO40.71
PIHIODOPHENYLA3DN40.71
F5B1,2,3,4,5-pentafluorobenzeneA3DN00.9
BT6benzenethiolA,B,C,D3HSR0.82
HFBhexafluorobenzeneA3DMZ0.78
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.7
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.7
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.7
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.7
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.7
PBCPHENYL BORONIC ACIDA2A320.71
PBCPHENYL BORONIC ACIDA1JU30.71
PHGPHENYLMERCURYA1CZS0.75
PA0Phenylarsine oxideA3E3Z0.74
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.75
IBF1,2,3,4,5-pentafluoro-6-iodobenzeneA3DN30.74
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
FIB1,2,3,4,5-pentafluoro-6-iodobenzeneA3DN80.74
BNSHYDROSULFONYLBENZENE11YYY0.75
BNSHYDROSULFONYLBENZENEA1MEM0.75
BNSHYDROSULFONYLBENZENEA,D,E1FH00.75
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.75