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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00015171

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CDHD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-ISODEHYDROVALINE
A1UZW0.73
DI63-[(4S)-2,5-DIOXOIMIDAZOLIDIN-4-
YL]PROPANOIC ACID
A2Q090.7
GGAD-GAMMA-GLUTAMYL-N-{[(R)-{4-[(4-
AMINOBUTYL)AMINO]BUTYL}(PHOSPHONOOXY)PHOSPHORYL]METHYL}-
D-ALANINAMIDE
A,B2IOA0.71
ACS1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-
(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-
(4R)-SULFANYLAZETIDIN-2-ONE
A1QJF0.71
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA4GRT0.86
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA,B1BZL0.86
CYKN-hexanoyl-L-homocysteineA3DHC0.77
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.88
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.88
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.91
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.91
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.7
ACWD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
B-METHYL-D-CYCLOPROPYLGLYCINE
B2IVI0.76
GSFL-GAMMA-GLUTAMYL-3-SULFINO-L-ALANYLGLYCINEA,B1YZX0.87
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.79
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.79
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.79
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.79
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.88
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.88
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.88
DDD(5R,10S)-5-{[(CARBOXYMETHYL)AMINO]CARBONYL}-
7-OXO-3-THIA-1,6-DIAZABICYCLO[4.4.1]UNDECANE-
10-CARBOXYLIC ACID
A2PFG0.74
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.96
GSHGLUTATHIONEA1EEM0.96
GSHGLUTATHIONEA,B1USB0.96
GSHGLUTATHIONEA3FZA0.96
GSHGLUTATHIONEA2IMF0.96
GSHGLUTATHIONEA,B1PX60.96
GSHGLUTATHIONEA,B1MD40.96
GSHGLUTATHIONEA2CZ20.96
GSHGLUTATHIONEA3FZ90.96
GSHGLUTATHIONEA,B,C,D1R4W0.96
GSHGLUTATHIONEA1ZHP0.96
GSHGLUTATHIONEA,B3E730.96
GSHGLUTATHIONEA1VF10.96
GSHGLUTATHIONEA3CRT0.96
GSHGLUTATHIONEA,B,C,D2VCX0.96
GSHGLUTATHIONEA,B,C,D1XW60.96
GSHGLUTATHIONEA3CRU0.96
GSHGLUTATHIONEA,B1B480.96
GSHGLUTATHIONEA2ZK20.96
GSHGLUTATHIONEA,B,C,D1IYH0.96
GSHGLUTATHIONEA,B,C,D1Q8M0.96
GSHGLUTATHIONEA,B,C,D2PBJ0.96
GSHGLUTATHIONEA,B,C,D2VCQ0.96
GSHGLUTATHIONEA1GRA0.96
GSHGLUTATHIONEA,B1QGJ0.96
GSHGLUTATHIONEA2HGS0.96
GSHGLUTATHIONEA,B,C,D2VD10.96
GSHGLUTATHIONEA1ZHM0.96
GSHGLUTATHIONEA,B,C,D2VCZ0.96
GSHGLUTATHIONEC1KCG0.96
GSHGLUTATHIONEA,B1MD30.96
GSHGLUTATHIONEA,B2IO90.96
GSHGLUTATHIONEA,B2JL40.96
GSHGLUTATHIONEA3DK80.96
GSHGLUTATHIONEA3DK40.96
GSHGLUTATHIONEA,B,D2VCW0.96
GSHGLUTATHIONEA,B1XW50.96
GSHGLUTATHIONEA,B3FHS0.96
GSHGLUTATHIONEA,B1Y1A0.96
GSHGLUTATHIONEA1GRE0.96
GSHGLUTATHIONEA,B2HT90.96
GSHGLUTATHIONEA,B1DUG0.96
GSHGLUTATHIONEA,B,C,D2VD00.96
GSHGLUTATHIONEA,B1TYP0.96
GSHGLUTATHIONEA2FLS0.96
GSHGLUTATHIONEA,B1OE80.96
GSHGLUTATHIONEA,B1PX70.96
GSHGLUTATHIONEA3C1S0.96
GSHGLUTATHIONEA,B1F3A0.96
GSHGLUTATHIONEA1FW10.96
GSHGLUTATHIONEA,B2IMI0.96
GSHGLUTATHIONEA,B1LBK0.96
GSHGLUTATHIONEA,B2HQM0.96
GSHGLUTATHIONEA,B1TDI0.96
GSHGLUTATHIONEA,B,C,D1V400.96
GSHGLUTATHIONEA,B,C,D1IYI0.96
GSHGLUTATHIONEA3D0Z0.96
GSHGLUTATHIONEA,B1ZGN0.96
GSHGLUTATHIONEA,B,C,D2CVD0.96
GSHGLUTATHIONEA,B3C8E0.96
GSHGLUTATHIONEA,B,C1YJ60.96
GSHGLUTATHIONEA2IMD0.96
GSHGLUTATHIONEA2IME0.96
GSHGLUTATHIONEA3BHJ0.96
GSHGLUTATHIONEA,B1OE70.96
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.78
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.72
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.73
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.78
ASVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-VINYLGLYCINE
A1ODM0.74
ASVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-VINYLGLYCINE
A1OBN0.74
ASVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-VINYLGLYCINE
A1OC10.74