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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02477488

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.76
DI63-[(4S)-2,5-DIOXOIMIDAZOLIDIN-4-
YL]PROPANOIC ACID
A2Q090.72
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,E,F,
G,H,I,J
2DB40.71
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.71
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,E,F1E790.71
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.76
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.83
GSHGLUTATHIONEA1EEM0.83
GSHGLUTATHIONEA,B1USB0.83
GSHGLUTATHIONEA3FZA0.83
GSHGLUTATHIONEA2IMF0.83
GSHGLUTATHIONEA,B1PX60.83
GSHGLUTATHIONEA,B1MD40.83
GSHGLUTATHIONEA2CZ20.83
GSHGLUTATHIONEA3FZ90.83
GSHGLUTATHIONEA,B,C,D1R4W0.83
GSHGLUTATHIONEA1ZHP0.83
GSHGLUTATHIONEA,B3E730.83
GSHGLUTATHIONEA1VF10.83
GSHGLUTATHIONEA3CRT0.83
GSHGLUTATHIONEA,B,C,D2VCX0.83
GSHGLUTATHIONEA,B,C,D1XW60.83
GSHGLUTATHIONEA3CRU0.83
GSHGLUTATHIONEA,B1B480.83
GSHGLUTATHIONEA2ZK20.83
GSHGLUTATHIONEA,B,C,D1IYH0.83
GSHGLUTATHIONEA,B,C,D1Q8M0.83
GSHGLUTATHIONEA,B,C,D2PBJ0.83
GSHGLUTATHIONEA,B,C,D2VCQ0.83
GSHGLUTATHIONEA1GRA0.83
GSHGLUTATHIONEA,B1QGJ0.83
GSHGLUTATHIONEA2HGS0.83
GSHGLUTATHIONEA,B,C,D2VD10.83
GSHGLUTATHIONEA1ZHM0.83
GSHGLUTATHIONEA,B,C,D2VCZ0.83
GSHGLUTATHIONEC1KCG0.83
GSHGLUTATHIONEA,B1MD30.83
GSHGLUTATHIONEA,B2IO90.83
GSHGLUTATHIONEA,B2JL40.83
GSHGLUTATHIONEA3DK80.83
GSHGLUTATHIONEA3DK40.83
GSHGLUTATHIONEA,B,D2VCW0.83
GSHGLUTATHIONEA,B1XW50.83
GSHGLUTATHIONEA,B3FHS0.83
GSHGLUTATHIONEA,B1Y1A0.83
GSHGLUTATHIONEA1GRE0.83
GSHGLUTATHIONEA,B2HT90.83
GSHGLUTATHIONEA,B1DUG0.83
GSHGLUTATHIONEA,B,C,D2VD00.83
GSHGLUTATHIONEA,B1TYP0.83
GSHGLUTATHIONEA2FLS0.83
GSHGLUTATHIONEA,B1OE80.83
GSHGLUTATHIONEA,B1PX70.83
GSHGLUTATHIONEA3C1S0.83
GSHGLUTATHIONEA,B1F3A0.83
GSHGLUTATHIONEA1FW10.83
GSHGLUTATHIONEA,B2IMI0.83
GSHGLUTATHIONEA,B1LBK0.83
GSHGLUTATHIONEA,B2HQM0.83
GSHGLUTATHIONEA,B1TDI0.83
GSHGLUTATHIONEA,B,C,D1V400.83
GSHGLUTATHIONEA,B,C,D1IYI0.83
GSHGLUTATHIONEA3D0Z0.83
GSHGLUTATHIONEA,B1ZGN0.83
GSHGLUTATHIONEA,B,C,D2CVD0.83
GSHGLUTATHIONEA,B3C8E0.83
GSHGLUTATHIONEA,B,C1YJ60.83
GSHGLUTATHIONEA2IMD0.83
GSHGLUTATHIONEA2IME0.83
GSHGLUTATHIONEA3BHJ0.83
GSHGLUTATHIONEA,B1OE70.83
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.72
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.79
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.74
GGAD-GAMMA-GLUTAMYL-N-{[(R)-{4-[(4-
AMINOBUTYL)AMINO]BUTYL}(PHOSPHONOOXY)PHOSPHORYL]METHYL}-
D-ALANINAMIDE
A,B2IOA0.78
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.78
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.78
GSN2-AMINO-5-[1-(CARBOXYLATOMETHYLCARBAMOYL)-
2-NITROSOSULFANYL-ETHYL]AMINO-5-
OXO-PENTANOATE
A,B2A2S0.82
GSN2-AMINO-5-[1-(CARBOXYLATOMETHYLCARBAMOYL)-
2-NITROSOSULFANYL-ETHYL]AMINO-5-
OXO-PENTANOATE
A,B2A2R0.82
FH7N^5^-formyl-N^5^-hydroxy-D-ornithineA,B,C2W6T0.75
FH7N^5^-formyl-N^5^-hydroxy-D-ornithineA,B,C2W780.75
FH7N^5^-formyl-N^5^-hydroxy-D-ornithineA,B,C2W770.75
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.79
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.79
GSFL-GAMMA-GLUTAMYL-3-SULFINO-L-ALANYLGLYCINEA,B1YZX0.8
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.7
AN0N-ACETYL-L-NORVALINEA1ZQ80.7
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.83
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.83
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.83
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.73
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W6T0.75
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W160.75
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W760.75
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W780.75
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W770.75
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA4GRT0.79
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA,B1BZL0.79
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B1BY50.79
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B,C2W6U0.79