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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00009123

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TOSP-SULFINOTOLUENEH1ETT0.83
TOSP-SULFINOTOLUENEI4PAD0.83
TOSP-SULFINOTOLUENEA1EST0.83
TOSP-SULFINOTOLUENEC,G2CHA0.83
TOSP-SULFINOTOLUENEE1PPH0.83
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.85
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.85
NAS2-NAPHTHALENESULFONIC ACIDI1QUR1
NAS2-NAPHTHALENESULFONIC ACIDE,I1PPC1
NAS2-NAPHTHALENESULFONIC ACIDH1ETS1
BDBA,B1KE30.73
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3B2Q0.71
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4T0.71
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4R0.71
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3EIU0.71
NTSNAPHTHALENE TRISULFONATEA1RML0.91
PMSBENZYLSULFINIC ACIDB1PNM0.76
PMSBENZYLSULFINIC ACIDA,B1SH70.76
PMSBENZYLSULFINIC ACIDB,C1BB00.76
PMSBENZYLSULFINIC ACIDA,B1S2N0.76
PMSBENZYLSULFINIC ACIDA,B1WB80.76
PMSBENZYLSULFINIC ACIDA,B,C3CE40.76
PMSBENZYLSULFINIC ACIDA,B1Y9Z0.76
PMSBENZYLSULFINIC ACIDA3H180.76
PMSBENZYLSULFINIC ACIDA3H170.76
PMSBENZYLSULFINIC ACIDA2CBG0.76
PMSBENZYLSULFINIC ACIDA1SUP0.76
PMSBENZYLSULFINIC ACIDA,B1V6C0.76
PMSBENZYLSULFINIC ACIDA,B1WPR0.76
PMSBENZYLSULFINIC ACIDA,B1EQ90.76
PMSBENZYLSULFINIC ACIDA,B1AUR0.76
PMSBENZYLSULFINIC ACIDA1KLT0.76
PMSBENZYLSULFINIC ACIDB,C1CA80.76
PMSBENZYLSULFINIC ACIDA2GKO0.76
PMSBENZYLSULFINIC ACIDB,C,D1BA80.76
F192-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATEA,B2CLO0.75
F192-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATEA,B2CLH0.75
MAJindane-5-sulfonamideA2QOA0.78
TLD4-methylbenzene-1,2-dithiolA2Z940.7
B69A2ZCR0.71
DSY5-(DIMETHYLAMINO)-2-NAPHTHALENESULFONIC ACIDC,D1BDA0.72
N2M5-AMINO-NAPHTALENE-2-MONOSULFONATEC,D1HKN0.77
BPSA,B2DE40.88
NPYNAPHTHALENEA,B1O7G0.78
ANS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONIC ACID(DANSYL ACID)H,J1CVW0.71
ANS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONIC ACID(DANSYL ACID)H,I1A4W0.71
ANS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONIC ACID(DANSYL ACID)H,I1FPC0.71
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.98
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.7
5NS5-aminonaphthalene-1-sulfonic acidA,B3CFT0.75
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
PEYPHENANTHRENEA,B2HML0.72
PEYPHENANTHRENEA,B2HMK0.72
TSUPARA-TOLUENE SULFONATEA,B1WUW0.84
TSUPARA-TOLUENE SULFONATEA1B0D0.84
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.74
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.74
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.74
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.74
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.74
B70tripotassium (1R)-4-biphenyl-4-
yl-1-phosphonatobutane-1-sulfonate
A2ZCS0.71
AN3ANTHRACENEA,B2HMN0.72
AN3ANTHRACENEA,B2HMM0.72