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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02381711

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CYKN-hexanoyl-L-homocysteineA3DHC0.73
GSN2-AMINO-5-[1-(CARBOXYLATOMETHYLCARBAMOYL)-
2-NITROSOSULFANYL-ETHYL]AMINO-5-
OXO-PENTANOATE
A,B2A2S0.86
GSN2-AMINO-5-[1-(CARBOXYLATOMETHYLCARBAMOYL)-
2-NITROSOSULFANYL-ETHYL]AMINO-5-
OXO-PENTANOATE
A,B2A2R0.86
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.84
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.84
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.84
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
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.92
ATAATRAZINE GLUTATHIONE CONJUGATEA,B,C,D1BYE0.7
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.71
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.81
CDHD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-ISODEHYDROVALINE
A1UZW0.7
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.76
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.76
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.76
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.76
EPMN-PALMITOYL-L-METHIONINEA,B1ZO90.75
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.73
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.82
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.82
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA4GRT0.8
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA,B1BZL0.8
DDD(5R,10S)-5-{[(CARBOXYMETHYL)AMINO]CARBONYL}-
7-OXO-3-THIA-1,6-DIAZABICYCLO[4.4.1]UNDECANE-
10-CARBOXYLIC ACID
A2PFG0.75
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.86
GSHGLUTATHIONEA1EEM0.86
GSHGLUTATHIONEA,B1USB0.86
GSHGLUTATHIONEA3FZA0.86
GSHGLUTATHIONEA2IMF0.86
GSHGLUTATHIONEA,B1PX60.86
GSHGLUTATHIONEA,B1MD40.86
GSHGLUTATHIONEA2CZ20.86
GSHGLUTATHIONEA3FZ90.86
GSHGLUTATHIONEA,B,C,D1R4W0.86
GSHGLUTATHIONEA1ZHP0.86
GSHGLUTATHIONEA,B3E730.86
GSHGLUTATHIONEA1VF10.86
GSHGLUTATHIONEA3CRT0.86
GSHGLUTATHIONEA,B,C,D2VCX0.86
GSHGLUTATHIONEA,B,C,D1XW60.86
GSHGLUTATHIONEA3CRU0.86
GSHGLUTATHIONEA,B1B480.86
GSHGLUTATHIONEA2ZK20.86
GSHGLUTATHIONEA,B,C,D1IYH0.86
GSHGLUTATHIONEA,B,C,D1Q8M0.86
GSHGLUTATHIONEA,B,C,D2PBJ0.86
GSHGLUTATHIONEA,B,C,D2VCQ0.86
GSHGLUTATHIONEA1GRA0.86
GSHGLUTATHIONEA,B1QGJ0.86
GSHGLUTATHIONEA2HGS0.86
GSHGLUTATHIONEA,B,C,D2VD10.86
GSHGLUTATHIONEA1ZHM0.86
GSHGLUTATHIONEA,B,C,D2VCZ0.86
GSHGLUTATHIONEC1KCG0.86
GSHGLUTATHIONEA,B1MD30.86
GSHGLUTATHIONEA,B2IO90.86
GSHGLUTATHIONEA,B2JL40.86
GSHGLUTATHIONEA3DK80.86
GSHGLUTATHIONEA3DK40.86
GSHGLUTATHIONEA,B,D2VCW0.86
GSHGLUTATHIONEA,B1XW50.86
GSHGLUTATHIONEA,B3FHS0.86
GSHGLUTATHIONEA,B1Y1A0.86
GSHGLUTATHIONEA1GRE0.86
GSHGLUTATHIONEA,B2HT90.86
GSHGLUTATHIONEA,B1DUG0.86
GSHGLUTATHIONEA,B,C,D2VD00.86
GSHGLUTATHIONEA,B1TYP0.86
GSHGLUTATHIONEA2FLS0.86
GSHGLUTATHIONEA,B1OE80.86
GSHGLUTATHIONEA,B1PX70.86
GSHGLUTATHIONEA3C1S0.86
GSHGLUTATHIONEA,B1F3A0.86
GSHGLUTATHIONEA1FW10.86
GSHGLUTATHIONEA,B2IMI0.86
GSHGLUTATHIONEA,B1LBK0.86
GSHGLUTATHIONEA,B2HQM0.86
GSHGLUTATHIONEA,B1TDI0.86
GSHGLUTATHIONEA,B,C,D1V400.86
GSHGLUTATHIONEA,B,C,D1IYI0.86
GSHGLUTATHIONEA3D0Z0.86
GSHGLUTATHIONEA,B1ZGN0.86
GSHGLUTATHIONEA,B,C,D2CVD0.86
GSHGLUTATHIONEA,B3C8E0.86
GSHGLUTATHIONEA,B,C1YJ60.86
GSHGLUTATHIONEA2IMD0.86
GSHGLUTATHIONEA2IME0.86
GSHGLUTATHIONEA3BHJ0.86
GSHGLUTATHIONEA,B1OE70.86
GGAD-GAMMA-GLUTAMYL-N-{[(R)-{4-[(4-
AMINOBUTYL)AMINO]BUTYL}(PHOSPHONOOXY)PHOSPHORYL]METHYL}-
D-ALANINAMIDE
A,B2IOA0.7
ACS1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-
(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-
(4R)-SULFANYLAZETIDIN-2-ONE
A1QJF0.74
ACWD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
B-METHYL-D-CYCLOPROPYLGLYCINE
B2IVI0.72
GSFL-GAMMA-GLUTAMYL-3-SULFINO-L-ALANYLGLYCINEA,B1YZX0.8