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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02963776

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.79
DMX3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-
1-SULFONATE
A,B,C,D1TP70.7
M283-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACIDA,B2NN10.72
M283-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACIDA2NNO0.72
M25N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDEA,B2NMX0.71
M25N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDEA2NNS0.71
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.7
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.7
B2FPHENYLALANINE BORONIC ACIDA,P1P060.7
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.7
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.7
BNSHYDROSULFONYLBENZENE11YYY0.76
BNSHYDROSULFONYLBENZENEA1MEM0.76
BNSHYDROSULFONYLBENZENEA,D,E1FH00.76
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.76
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3B2Q0.82
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4T0.82
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4R0.82
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3EIU0.82
B69A2ZCR0.71
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.71
FPRPROPYLBENZENEC1RHK0.77
I4BISOBUTYLBENZENEA184L0.75
AM44-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDEA1TX80.71
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.71
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.71
BPSA,B2DE40.85
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.88
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.88
BDBA,B1KE30.71
M29ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATEA2NNV0.72
M29ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATEA,B2NN70.72
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2OUA0.84
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B,C,D2AJC0.84
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B3PRO0.84
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2PFE0.84
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.74