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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03413072

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.85
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.85
F192-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATEA,B2CLO0.72
F192-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATEA,B2CLH0.72
BDBA,B1KE30.73
B70tripotassium (1R)-4-biphenyl-4-
yl-1-phosphonatobutane-1-sulfonate
A2ZCS0.73
NTSNAPHTHALENE TRISULFONATEA1RML0.89
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.71
N2M5-AMINO-NAPHTALENE-2-MONOSULFONATEC,D1HKN0.72
OXEORTHO-XYLENEA,B3E0X0.72
OXEORTHO-XYLENEA188L0.72
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.72
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.91
5NS5-aminonaphthalene-1-sulfonic acidA,B3CFT0.7
B69A2ZCR0.73
MAJindane-5-sulfonamideA2QOA0.83
NAS2-NAPHTHALENESULFONIC ACIDI1QUR0.94
NAS2-NAPHTHALENESULFONIC ACIDE,I1PPC0.94
NAS2-NAPHTHALENESULFONIC ACIDH1ETS0.94
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2OUA0.75
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B,C,D2AJC0.75
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B3PRO0.75
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2PFE0.75
AN3ANTHRACENEA,B2HMN0.7
AN3ANTHRACENEA,B2HMM0.7
BNSHYDROSULFONYLBENZENE11YYY0.73
BNSHYDROSULFONYLBENZENEA1MEM0.73
BNSHYDROSULFONYLBENZENEA,D,E1FH00.73
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.73
NPYNAPHTHALENEA,B1O7G0.76
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3B2Q0.75
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4T0.75
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4R0.75
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3EIU0.75
BPSA,B2DE40.86