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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00494337

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HFTHYDROXYFLUTAMIDEA2AX60.7
DOE(S)-2-(4-(2-(2-HYDROXYETHYLTHIO)-
ACETAMIDO)-BENZYL)-1,4,7,10-TETRAAZACYCLODODECANE-
N,N',N'',N'''-TETRAACETATE
A,B,C,D1NC20.74
NC1NITROCEFIN ACYL-SERINEA,B1MWS0.7
NC1NITROCEFIN ACYL-SERINEA2UWX0.7
01W(2S)-2-ammonio-4-[(2,4-dinitrophenyl)amino]butanoateA,B3DS90.71
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B2OAD0.79
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B,C,D,E,F1GTI0.79
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B2OAC0.79
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B1GLQ0.79
GTBS-(P-NITROBENZYL)GLUTATHIONEB,D2QMC0.79
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B2VO40.79
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B,C,D1K0C0.79
G23(2R,4S)-2-[(R)-BENZYLCARBAMOYL-
PHENYLACETYL-METHYL]-5,5-DIMETHYL-
THIAZOLIDINE-4-CARBOXYLIC ACID
A1HTE0.71
TNBS-(2,3,6-TRINITROPHENYL)CYSTEINEA,B,C,D,E,F,
G,H
1AQX0.74
TYXS-(2-ANILINO-2-OXOETHYL)-L-CYSTEINEA2PQT0.75
FOE2-(2-AMINO-3-OXO-PROPYLSULFANYL)-
N-(4-FLUORO-PHENYL)-N-ISOPROPYL-
ACETAMIDE
B1BX90.71
PNCPARA-NITROBENZYL GLUTARYL GLYCINIC ACIDL1YEF0.8
NP1N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINEA1WUG0.71
LO1[[4-(AMINOMETHYL)PHENYL]AMINO]OXO-
ACETIC ACID,
A1WAX0.72
PPNPARA-NITROPHENYLALANINEI1YTJ0.74
DOF(S)-2-(4-NITROBENZYL)-1,4,7,10-
TETRAAZACYCLODODECANE-N,N',N'',N'''-
TETRAACETATE
A,B,C,D1NC40.75
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B5GST0.7
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A1HNA0.7
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B1VF30.7
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B,C,D1HNC0.7
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B,C1XWK0.7
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B18GS0.7
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A1GSQ0.7
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B1HNB0.7
BNI5-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-
6-YL)-PENTANOIC ACID (4-NITRO-PHENYL)-
AMIDE
A,B1RXH0.71
BNI5-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-
6-YL)-PENTANOIC ACID (4-NITRO-PHENYL)-
AMIDE
A,B1I9H0.71
BNI5-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-
6-YL)-PENTANOIC ACID (4-NITRO-PHENYL)-
AMIDE
A,B2FHL0.71
BNI5-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-
6-YL)-PENTANOIC ACID (4-NITRO-PHENYL)-
AMIDE
A,B1RXK0.71
BNI5-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-
6-YL)-PENTANOIC ACID (4-NITRO-PHENYL)-
AMIDE
A,B2OFB0.71
BNI5-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-
6-YL)-PENTANOIC ACID (4-NITRO-PHENYL)-
AMIDE
A,B1IJ80.71
BNI5-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-
6-YL)-PENTANOIC ACID (4-NITRO-PHENYL)-
AMIDE
A,B2OF80.71
BNI5-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-
6-YL)-PENTANOIC ACID (4-NITRO-PHENYL)-
AMIDE
A,B,C,D1RXJ0.71
BNI5-(2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-
6-YL)-PENTANOIC ACID (4-NITRO-PHENYL)-
AMIDE
X,Y2FHN0.71