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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03616969

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.71
GTXS-HEXYLGLUTATHIONEA,B1K3Y0.71
GTXS-HEXYLGLUTATHIONEA,B1AGS0.71
GTXS-HEXYLGLUTATHIONEA,B1PN90.71
GTXS-HEXYLGLUTATHIONEA,B1Q4J0.71
GTXS-HEXYLGLUTATHIONEA,B2IMK0.71
GTXS-HEXYLGLUTATHIONEA,B4GSS0.71
GTXS-HEXYLGLUTATHIONEA,B,C1GWC0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D2C3Q0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D1TU80.71
GTXS-HEXYLGLUTATHIONEA,B2GLR0.71
GTXS-HEXYLGLUTATHIONEA,B2OA70.71
GTXS-HEXYLGLUTATHIONEA,C2AAW0.71
GTXS-HEXYLGLUTATHIONEA,B1VF20.71
GTXS-HEXYLGLUTATHIONEA1M9A0.71
GTXS-HEXYLGLUTATHIONEA,B17GS0.71
GTXS-HEXYLGLUTATHIONEA,B1K0A0.71
GTXS-HEXYLGLUTATHIONEA,B2R3X0.71
GTXS-HEXYLGLUTATHIONEA,B1GSU0.71
GTXS-HEXYLGLUTATHIONEA,B2C800.71
GTXS-HEXYLGLUTATHIONEA,B2R6K0.71
GTXS-HEXYLGLUTATHIONEA,B1PGT0.71
GTXS-HEXYLGLUTATHIONEA,B2J9H0.71
GTXS-HEXYLGLUTATHIONEA,B1K3L0.71
GTXS-HEXYLGLUTATHIONEA,B1GNW0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D1BH50.71
GTXS-HEXYLGLUTATHIONEA,B1YDK0.71
GTXS-HEXYLGLUTATHIONEA,B9GSS0.71
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.73
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.73
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.76
GSHGLUTATHIONEA1EEM0.76
GSHGLUTATHIONEA,B1USB0.76
GSHGLUTATHIONEA3FZA0.76
GSHGLUTATHIONEA2IMF0.76
GSHGLUTATHIONEA,B1PX60.76
GSHGLUTATHIONEA,B1MD40.76
GSHGLUTATHIONEA2CZ20.76
GSHGLUTATHIONEA3FZ90.76
GSHGLUTATHIONEA,B,C,D1R4W0.76
GSHGLUTATHIONEA1ZHP0.76
GSHGLUTATHIONEA,B3E730.76
GSHGLUTATHIONEA1VF10.76
GSHGLUTATHIONEA3CRT0.76
GSHGLUTATHIONEA,B,C,D2VCX0.76
GSHGLUTATHIONEA,B,C,D1XW60.76
GSHGLUTATHIONEA3CRU0.76
GSHGLUTATHIONEA,B1B480.76
GSHGLUTATHIONEA2ZK20.76
GSHGLUTATHIONEA,B,C,D1IYH0.76
GSHGLUTATHIONEA,B,C,D1Q8M0.76
GSHGLUTATHIONEA,B,C,D2PBJ0.76
GSHGLUTATHIONEA,B,C,D2VCQ0.76
GSHGLUTATHIONEA1GRA0.76
GSHGLUTATHIONEA,B1QGJ0.76
GSHGLUTATHIONEA2HGS0.76
GSHGLUTATHIONEA,B,C,D2VD10.76
GSHGLUTATHIONEA1ZHM0.76
GSHGLUTATHIONEA,B,C,D2VCZ0.76
GSHGLUTATHIONEC1KCG0.76
GSHGLUTATHIONEA,B1MD30.76
GSHGLUTATHIONEA,B2IO90.76
GSHGLUTATHIONEA,B2JL40.76
GSHGLUTATHIONEA3DK80.76
GSHGLUTATHIONEA3DK40.76
GSHGLUTATHIONEA,B,D2VCW0.76
GSHGLUTATHIONEA,B1XW50.76
GSHGLUTATHIONEA,B3FHS0.76
GSHGLUTATHIONEA,B1Y1A0.76
GSHGLUTATHIONEA1GRE0.76
GSHGLUTATHIONEA,B2HT90.76
GSHGLUTATHIONEA,B1DUG0.76
GSHGLUTATHIONEA,B,C,D2VD00.76
GSHGLUTATHIONEA,B1TYP0.76
GSHGLUTATHIONEA2FLS0.76
GSHGLUTATHIONEA,B1OE80.76
GSHGLUTATHIONEA,B1PX70.76
GSHGLUTATHIONEA3C1S0.76
GSHGLUTATHIONEA,B1F3A0.76
GSHGLUTATHIONEA1FW10.76
GSHGLUTATHIONEA,B2IMI0.76
GSHGLUTATHIONEA,B1LBK0.76
GSHGLUTATHIONEA,B2HQM0.76
GSHGLUTATHIONEA,B1TDI0.76
GSHGLUTATHIONEA,B,C,D1V400.76
GSHGLUTATHIONEA,B,C,D1IYI0.76
GSHGLUTATHIONEA3D0Z0.76
GSHGLUTATHIONEA,B1ZGN0.76
GSHGLUTATHIONEA,B,C,D2CVD0.76
GSHGLUTATHIONEA,B3C8E0.76
GSHGLUTATHIONEA,B,C1YJ60.76
GSHGLUTATHIONEA2IMD0.76
GSHGLUTATHIONEA2IME0.76
GSHGLUTATHIONEA3BHJ0.76
GSHGLUTATHIONEA,B1OE70.76
CYKN-hexanoyl-L-homocysteineA3DHC0.75
ATIN-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACIDA1Y0Y0.72
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.71
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.71
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.72
1583-(2-MERCAPTO-ACETYLAMINO)-4-OXO-
PENTANOIC ACID
A,B1NME0.87
1583-(2-MERCAPTO-ACETYLAMINO)-4-OXO-
PENTANOIC ACID
A1RWK0.87
CDHD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-ISODEHYDROVALINE
A1UZW0.72
HFVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-L-3,3,3,3',3',3'-HEXAFLUOROVALINE
A2BU90.76
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W050.78
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W060.78
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.73
MDZN~6~-METHYL-6-OXO-L-LYSINE - 2-
[(3-MERCAPTOBUTANOYL)OXY]-3-METHYLBUTANOIC ACID
A1W3V0.7
VB1N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}-
2-oxo-1-(sulfanylmethyl)ethyl]-
6-oxo-L-lysine
A2VBP0.78
ACWD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
B-METHYL-D-CYCLOPROPYLGLYCINE
B2IVI0.76
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.72
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.79
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W030.77
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W040.77
TGGGAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINEA2F2K0.72
TGGGAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINEA,B2V6K0.72
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.7
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PPP0.71
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PE60.71
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1ITO0.71
SIC(2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin-
1-yl]-3-sulfanylpropanoic acid
A,B3DIP0.7
M11N^6^-[(1R,2S)-1-({[(1R)-1-carboxy-
2-methylpropyl]oxy}carbonyl)-2-
sulfanylpropyl]-6-oxo-L-lysine
A2VE10.7
M11N^6^-[(1R,2S)-1-({[(1R)-1-carboxy-
2-methylpropyl]oxy}carbonyl)-2-
sulfanylpropyl]-6-oxo-L-lysine
A2VCM0.7
DZEmethyl (3S)-3-[(tert-butoxycarbonyl)amino]-
4-oxopentanoate
A,B,C,D3GJR0.71
ACS1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-
(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-
(4R)-SULFANYLAZETIDIN-2-ONE
A1QJF0.7
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.71
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.71
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.71
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.75
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA4GRT0.71
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA,B1BZL0.71
2Z9N-acetyl-L-alpha-aspartyl-L-alpha-
glutamyl-N-[(1R)-2-carboxy-1-formylethyl]-
L-valinamide
A,B3H1P0.73
OCVN6-[(1R)-2-{[(1R)-1-CARBOXY-2-METHYLPROPYL]OXY}-
1-(MERCAPTOMETHYL)-2-OXOETHYL]-
6-OXO-D-LYSINE
A1HB10.7
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.7
RGS4N-MALONYL-CYSTEINYL-2,4-DIAMINOBUTYRATE DISULFIDEA4GR10.71
TS5GLUTATHIONYLSPERMIDINEA1I5G0.73
GTTGLUTATHIONEA,B11GS0.76
GTTGLUTATHIONEA1GSN0.76
GTTGLUTATHIONEA,C1K0B0.76
GTTGLUTATHIONEA,B,C1K0D0.76
GTTGLUTATHIONEA,B6GSY0.76
GTTGLUTATHIONEA,B19GS0.76
GTTGLUTATHIONEA1FLJ0.76
GTTGLUTATHIONEA,B3DD30.76
GTTGLUTATHIONEA2PVQ0.76
GTTGLUTATHIONEA1DNC0.76
GTTGLUTATHIONEA,B,C,D,E,F,
G,H,I,J,K,L
2PNO0.76
GTTGLUTATHIONEA,B,C,D3CSI0.76
GTTGLUTATHIONEA,B6GSS0.76
GTTGLUTATHIONEA2R4V0.76
GTTGLUTATHIONEA,B,C,D3FZ50.76
GTTGLUTATHIONEA,B3GSS0.76
GTTGLUTATHIONEA,B2F8F0.76
GTTGLUTATHIONEA,B1GSY0.76
GTTGLUTATHIONEA1PMT0.76
GTTGLUTATHIONEA,B1GSE0.76
GTTGLUTATHIONEA,B,C,D1F2E0.76
GTTGLUTATHIONEA1UW30.76
GTTGLUTATHIONEA,B1SS40.76
GTTGLUTATHIONEA,B5GSS0.76
GTTGLUTATHIONEA1GRX0.76
GTTGLUTATHIONEA,B7GSS0.76
GTTGLUTATHIONEA1UA50.76
GTTGLUTATHIONEA,B,C8GSS0.76
GTTGLUTATHIONEA,B1LJR0.76
GTTGLUTATHIONEA,B,C,D1OYJ0.76
GTTGLUTATHIONEA,B,C,D2E7P0.76
GTTGLUTATHIONEA,B,C,D,E,F2GDR0.76
GTTGLUTATHIONEA,B,C,D2WEM0.76
GTTGLUTATHIONEA,B1K0A0.76
GTTGLUTATHIONEA,B3EE20.76
GTTGLUTATHIONEA3G5S0.76
GTTGLUTATHIONEA1HNL0.76
GTTGLUTATHIONEA,B,C,D1K0C0.76
GTTGLUTATHIONEA,B6GST0.76
GTTGLUTATHIONEA,B1TU70.76
GTTGLUTATHIONEA2H8A0.76
GTTGLUTATHIONEA,B,C,D2PMT0.76
GTTGLUTATHIONEA2UUH0.76
GTTGLUTATHIONEA,B1ZL90.76
GTTGLUTATHIONEA,B1QH50.76
GTTGLUTATHIONE1,21PD20.76
GTTGLUTATHIONEA,B3CSH0.76
GTTGLUTATHIONEA,C1JZR0.76
GTTGLUTATHIONEA2NTO0.76
GTTGLUTATHIONEA,B1KBN0.76
GTTGLUTATHIONEA3GRX0.76
GTTGLUTATHIONEA1B4Q0.76
GTTGLUTATHIONEA,B1PKW0.76
GTTGLUTATHIONEA1K0N0.76
GTTGLUTATHIONEA,B,C,D2DSA0.76
GTTGLUTATHIONEA,B2HNL0.76
GTTGLUTATHIONEA,B,C,D,E,F,
G,H
2ON50.76
GTTGLUTATHIONEA1GSA0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1FHE0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CA80.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1GNE0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B3D5J0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H
2VCR0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2WCI0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1OYJ0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U3I0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1XA80.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2BRQ0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CAQ0.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U870.76
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B1M0U0.76
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRK0.71
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRL0.71
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.82
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.82
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.82
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.82