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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00029601

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GSN2-AMINO-5-[1-(CARBOXYLATOMETHYLCARBAMOYL)-
2-NITROSOSULFANYL-ETHYL]AMINO-5-
OXO-PENTANOATE
A,B2A2S0.72
GSN2-AMINO-5-[1-(CARBOXYLATOMETHYLCARBAMOYL)-
2-NITROSOSULFANYL-ETHYL]AMINO-5-
OXO-PENTANOATE
A,B2A2R0.72
DI63-[(4S)-2,5-DIOXOIMIDAZOLIDIN-4-
YL]PROPANOIC ACID
A2Q090.72
GTXS-HEXYLGLUTATHIONEA,B1K3Y0.76
GTXS-HEXYLGLUTATHIONEA,B1AGS0.76
GTXS-HEXYLGLUTATHIONEA,B1PN90.76
GTXS-HEXYLGLUTATHIONEA,B1Q4J0.76
GTXS-HEXYLGLUTATHIONEA,B2IMK0.76
GTXS-HEXYLGLUTATHIONEA,B4GSS0.76
GTXS-HEXYLGLUTATHIONEA,B,C1GWC0.76
GTXS-HEXYLGLUTATHIONEA,B,C,D2C3Q0.76
GTXS-HEXYLGLUTATHIONEA,B,C,D1TU80.76
GTXS-HEXYLGLUTATHIONEA,B2GLR0.76
GTXS-HEXYLGLUTATHIONEA,B2OA70.76
GTXS-HEXYLGLUTATHIONEA,C2AAW0.76
GTXS-HEXYLGLUTATHIONEA,B1VF20.76
GTXS-HEXYLGLUTATHIONEA1M9A0.76
GTXS-HEXYLGLUTATHIONEA,B17GS0.76
GTXS-HEXYLGLUTATHIONEA,B1K0A0.76
GTXS-HEXYLGLUTATHIONEA,B2R3X0.76
GTXS-HEXYLGLUTATHIONEA,B1GSU0.76
GTXS-HEXYLGLUTATHIONEA,B2C800.76
GTXS-HEXYLGLUTATHIONEA,B2R6K0.76
GTXS-HEXYLGLUTATHIONEA,B1PGT0.76
GTXS-HEXYLGLUTATHIONEA,B2J9H0.76
GTXS-HEXYLGLUTATHIONEA,B1K3L0.76
GTXS-HEXYLGLUTATHIONEA,B1GNW0.76
GTXS-HEXYLGLUTATHIONEA,B,C,D1BH50.76
GTXS-HEXYLGLUTATHIONEA,B1YDK0.76
GTXS-HEXYLGLUTATHIONEA,B9GSS0.76
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.71
GSHGLUTATHIONEA1EEM0.71
GSHGLUTATHIONEA,B1USB0.71
GSHGLUTATHIONEA3FZA0.71
GSHGLUTATHIONEA2IMF0.71
GSHGLUTATHIONEA,B1PX60.71
GSHGLUTATHIONEA,B1MD40.71
GSHGLUTATHIONEA2CZ20.71
GSHGLUTATHIONEA3FZ90.71
GSHGLUTATHIONEA,B,C,D1R4W0.71
GSHGLUTATHIONEA1ZHP0.71
GSHGLUTATHIONEA,B3E730.71
GSHGLUTATHIONEA1VF10.71
GSHGLUTATHIONEA3CRT0.71
GSHGLUTATHIONEA,B,C,D2VCX0.71
GSHGLUTATHIONEA,B,C,D1XW60.71
GSHGLUTATHIONEA3CRU0.71
GSHGLUTATHIONEA,B1B480.71
GSHGLUTATHIONEA2ZK20.71
GSHGLUTATHIONEA,B,C,D1IYH0.71
GSHGLUTATHIONEA,B,C,D1Q8M0.71
GSHGLUTATHIONEA,B,C,D2PBJ0.71
GSHGLUTATHIONEA,B,C,D2VCQ0.71
GSHGLUTATHIONEA1GRA0.71
GSHGLUTATHIONEA,B1QGJ0.71
GSHGLUTATHIONEA2HGS0.71
GSHGLUTATHIONEA,B,C,D2VD10.71
GSHGLUTATHIONEA1ZHM0.71
GSHGLUTATHIONEA,B,C,D2VCZ0.71
GSHGLUTATHIONEC1KCG0.71
GSHGLUTATHIONEA,B1MD30.71
GSHGLUTATHIONEA,B2IO90.71
GSHGLUTATHIONEA,B2JL40.71
GSHGLUTATHIONEA3DK80.71
GSHGLUTATHIONEA3DK40.71
GSHGLUTATHIONEA,B,D2VCW0.71
GSHGLUTATHIONEA,B1XW50.71
GSHGLUTATHIONEA,B3FHS0.71
GSHGLUTATHIONEA,B1Y1A0.71
GSHGLUTATHIONEA1GRE0.71
GSHGLUTATHIONEA,B2HT90.71
GSHGLUTATHIONEA,B1DUG0.71
GSHGLUTATHIONEA,B,C,D2VD00.71
GSHGLUTATHIONEA,B1TYP0.71
GSHGLUTATHIONEA2FLS0.71
GSHGLUTATHIONEA,B1OE80.71
GSHGLUTATHIONEA,B1PX70.71
GSHGLUTATHIONEA3C1S0.71
GSHGLUTATHIONEA,B1F3A0.71
GSHGLUTATHIONEA1FW10.71
GSHGLUTATHIONEA,B2IMI0.71
GSHGLUTATHIONEA,B1LBK0.71
GSHGLUTATHIONEA,B2HQM0.71
GSHGLUTATHIONEA,B1TDI0.71
GSHGLUTATHIONEA,B,C,D1V400.71
GSHGLUTATHIONEA,B,C,D1IYI0.71
GSHGLUTATHIONEA3D0Z0.71
GSHGLUTATHIONEA,B1ZGN0.71
GSHGLUTATHIONEA,B,C,D2CVD0.71
GSHGLUTATHIONEA,B3C8E0.71
GSHGLUTATHIONEA,B,C1YJ60.71
GSHGLUTATHIONEA2IMD0.71
GSHGLUTATHIONEA2IME0.71
GSHGLUTATHIONEA3BHJ0.71
GSHGLUTATHIONEA,B1OE70.71
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA4GRT0.74
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA,B1BZL0.74
TS5GLUTATHIONYLSPERMIDINEA1I5G0.76
MUDN-{[(1R)-1-carboxy-2-(methylsulfanyl)ethyl]carbamoyl}-
L-glutamic acid
A3D7G0.72
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
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.74
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.73
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.73
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.73
GTYL-GAMMA-GLUTAMYL-S-OCTYL-D-CYSTEINYLGLYCINEA1U880.75
TS4GLUTATHIONYLSPERMIDINE DISULFIDEA5GRT0.74
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,E,F,
G,H,I,J
2DB40.7
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
2DYS0.7
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,E,F1E790.7
TS22-AMINO-4-[4-(4-AMINO-4-CARBOXY-
BUTYRYLAMINO)-5,8,19,22-TETRAOXO-
1,2-DITHIA-6,9,13,18,21-PENTAAZA-
CYCLOTETRACOS-23-YLCARBAMOYL]-BUTYRIC ACID
A3GRT0.74
DDD(5R,10S)-5-{[(CARBOXYMETHYL)AMINO]CARBONYL}-
7-OXO-3-THIA-1,6-DIAZABICYCLO[4.4.1]UNDECANE-
10-CARBOXYLIC ACID
A2PFG0.7
GTTGLUTATHIONEA,B11GS0.71
GTTGLUTATHIONEA1GSN0.71
GTTGLUTATHIONEA,C1K0B0.71
GTTGLUTATHIONEA,B,C1K0D0.71
GTTGLUTATHIONEA,B6GSY0.71
GTTGLUTATHIONEA,B19GS0.71
GTTGLUTATHIONEA1FLJ0.71
GTTGLUTATHIONEA,B3DD30.71
GTTGLUTATHIONEA2PVQ0.71
GTTGLUTATHIONEA1DNC0.71
GTTGLUTATHIONEA,B,C,D,E,F,
G,H,I,J,K,L
2PNO0.71
GTTGLUTATHIONEA,B,C,D3CSI0.71
GTTGLUTATHIONEA,B6GSS0.71
GTTGLUTATHIONEA2R4V0.71
GTTGLUTATHIONEA,B,C,D3FZ50.71
GTTGLUTATHIONEA,B3GSS0.71
GTTGLUTATHIONEA,B2F8F0.71
GTTGLUTATHIONEA,B1GSY0.71
GTTGLUTATHIONEA1PMT0.71
GTTGLUTATHIONEA,B1GSE0.71
GTTGLUTATHIONEA,B,C,D1F2E0.71
GTTGLUTATHIONEA1UW30.71
GTTGLUTATHIONEA,B1SS40.71
GTTGLUTATHIONEA,B5GSS0.71
GTTGLUTATHIONEA1GRX0.71
GTTGLUTATHIONEA,B7GSS0.71
GTTGLUTATHIONEA1UA50.71
GTTGLUTATHIONEA,B,C8GSS0.71
GTTGLUTATHIONEA,B1LJR0.71
GTTGLUTATHIONEA,B,C,D1OYJ0.71
GTTGLUTATHIONEA,B,C,D2E7P0.71
GTTGLUTATHIONEA,B,C,D,E,F2GDR0.71
GTTGLUTATHIONEA,B,C,D2WEM0.71
GTTGLUTATHIONEA,B1K0A0.71
GTTGLUTATHIONEA,B3EE20.71
GTTGLUTATHIONEA3G5S0.71
GTTGLUTATHIONEA1HNL0.71
GTTGLUTATHIONEA,B,C,D1K0C0.71
GTTGLUTATHIONEA,B6GST0.71
GTTGLUTATHIONEA,B1TU70.71
GTTGLUTATHIONEA2H8A0.71
GTTGLUTATHIONEA,B,C,D2PMT0.71
GTTGLUTATHIONEA2UUH0.71
GTTGLUTATHIONEA,B1ZL90.71
GTTGLUTATHIONEA,B1QH50.71
GTTGLUTATHIONE1,21PD20.71
GTTGLUTATHIONEA,B3CSH0.71
GTTGLUTATHIONEA,C1JZR0.71
GTTGLUTATHIONEA2NTO0.71
GTTGLUTATHIONEA,B1KBN0.71
GTTGLUTATHIONEA3GRX0.71
GTTGLUTATHIONEA1B4Q0.71
GTTGLUTATHIONEA,B1PKW0.71
GTTGLUTATHIONEA1K0N0.71
GTTGLUTATHIONEA,B,C,D2DSA0.71
GTTGLUTATHIONEA,B2HNL0.71
GTTGLUTATHIONEA,B,C,D,E,F,
G,H
2ON50.71
GTTGLUTATHIONEA1GSA0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1FHE0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CA80.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1GNE0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B3D5J0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H
2VCR0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2WCI0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1OYJ0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U3I0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1XA80.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2BRQ0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CAQ0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U870.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B1M0U0.71