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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00485234

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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
DI63-[(4S)-2,5-DIOXOIMIDAZOLIDIN-4-
YL]PROPANOIC ACID
A2Q090.78
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA,B,C,D2APH0.73
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDB2FCI0.73
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA1B9U0.73
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA,P1TWQ0.73
GSFL-GAMMA-GLUTAMYL-3-SULFINO-L-ALANYLGLYCINEA,B1YZX0.72
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.75
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.75
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1FHE0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CA80.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1GNE0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B3D5J0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H
2VCR0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2WCI0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1OYJ0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U3I0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1XA80.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2BRQ0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CAQ0.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U870.77
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B1M0U0.77
CIRCITRULLINEA,B,C,D1J210.71
CIRCITRULLINEB1KOD0.71
CIRCITRULLINEA,B,C3B3I0.71
CIRCITRULLINEC3DTX0.71
CIRCITRULLINEA2C6Z0.71
CIRCITRULLINEA,C,E,F2W650.71
CIRCITRULLINEA,B2JAI0.71
CIRCITRULLINEP3FT20.71
CIRCITRULLINEA,B,C,D1J1Z0.71
CIRCITRULLINEA,B1LXY0.71
CIRCITRULLINEF,H1OL10.71
CIRCITRULLINEA1KP30.71
CIRCITRULLINEA2NZ20.71
CIRCITRULLINEA1H700.71
CIRCITRULLINEA1K970.71
CIRCITRULLINEC3B6S0.71
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.74
GTTGLUTATHIONEA,B11GS0.77
GTTGLUTATHIONEA1GSN0.77
GTTGLUTATHIONEA,C1K0B0.77
GTTGLUTATHIONEA,B,C1K0D0.77
GTTGLUTATHIONEA,B6GSY0.77
GTTGLUTATHIONEA,B19GS0.77
GTTGLUTATHIONEA1FLJ0.77
GTTGLUTATHIONEA,B3DD30.77
GTTGLUTATHIONEA2PVQ0.77
GTTGLUTATHIONEA1DNC0.77
GTTGLUTATHIONEA,B,C,D,E,F,
G,H,I,J,K,L
2PNO0.77
GTTGLUTATHIONEA,B,C,D3CSI0.77
GTTGLUTATHIONEA,B6GSS0.77
GTTGLUTATHIONEA2R4V0.77
GTTGLUTATHIONEA,B,C,D3FZ50.77
GTTGLUTATHIONEA,B3GSS0.77
GTTGLUTATHIONEA,B2F8F0.77
GTTGLUTATHIONEA,B1GSY0.77
GTTGLUTATHIONEA1PMT0.77
GTTGLUTATHIONEA,B1GSE0.77
GTTGLUTATHIONEA,B,C,D1F2E0.77
GTTGLUTATHIONEA1UW30.77
GTTGLUTATHIONEA,B1SS40.77
GTTGLUTATHIONEA,B5GSS0.77
GTTGLUTATHIONEA1GRX0.77
GTTGLUTATHIONEA,B7GSS0.77
GTTGLUTATHIONEA1UA50.77
GTTGLUTATHIONEA,B,C8GSS0.77
GTTGLUTATHIONEA,B1LJR0.77
GTTGLUTATHIONEA,B,C,D1OYJ0.77
GTTGLUTATHIONEA,B,C,D2E7P0.77
GTTGLUTATHIONEA,B,C,D,E,F2GDR0.77
GTTGLUTATHIONEA,B,C,D2WEM0.77
GTTGLUTATHIONEA,B1K0A0.77
GTTGLUTATHIONEA,B3EE20.77
GTTGLUTATHIONEA3G5S0.77
GTTGLUTATHIONEA1HNL0.77
GTTGLUTATHIONEA,B,C,D1K0C0.77
GTTGLUTATHIONEA,B6GST0.77
GTTGLUTATHIONEA,B1TU70.77
GTTGLUTATHIONEA2H8A0.77
GTTGLUTATHIONEA,B,C,D2PMT0.77
GTTGLUTATHIONEA2UUH0.77
GTTGLUTATHIONEA,B1ZL90.77
GTTGLUTATHIONEA,B1QH50.77
GTTGLUTATHIONE1,21PD20.77
GTTGLUTATHIONEA,B3CSH0.77
GTTGLUTATHIONEA,C1JZR0.77
GTTGLUTATHIONEA2NTO0.77
GTTGLUTATHIONEA,B1KBN0.77
GTTGLUTATHIONEA3GRX0.77
GTTGLUTATHIONEA1B4Q0.77
GTTGLUTATHIONEA,B1PKW0.77
GTTGLUTATHIONEA1K0N0.77
GTTGLUTATHIONEA,B,C,D2DSA0.77
GTTGLUTATHIONEA,B2HNL0.77
GTTGLUTATHIONEA,B,C,D,E,F,
G,H
2ON50.77
GTTGLUTATHIONEA1GSA0.77
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.73
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.73
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.73
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B1BY50.72
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B,C2W6U0.72
GTSGLUTATHIONE SULFONIC ACIDA,B1A0F0.71
GTSGLUTATHIONE SULFONIC ACIDA,B1GLP0.71
GTSGLUTATHIONE SULFONIC ACIDA,B1N2A0.71
GTSGLUTATHIONE SULFONIC ACIDA,B,C,D1V2A0.71
GTSGLUTATHIONE SULFONIC ACIDA1M990.71
GTSGLUTATHIONE SULFONIC ACIDA1R5A0.71
GTSGLUTATHIONE SULFONIC ACIDA,C,D1EV90.71
GTSGLUTATHIONE SULFONIC ACIDA,C,D1EV40.71
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.73
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.73
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.77
GSHGLUTATHIONEA1EEM0.77
GSHGLUTATHIONEA,B1USB0.77
GSHGLUTATHIONEA3FZA0.77
GSHGLUTATHIONEA2IMF0.77
GSHGLUTATHIONEA,B1PX60.77
GSHGLUTATHIONEA,B1MD40.77
GSHGLUTATHIONEA2CZ20.77
GSHGLUTATHIONEA3FZ90.77
GSHGLUTATHIONEA,B,C,D1R4W0.77
GSHGLUTATHIONEA1ZHP0.77
GSHGLUTATHIONEA,B3E730.77
GSHGLUTATHIONEA1VF10.77
GSHGLUTATHIONEA3CRT0.77
GSHGLUTATHIONEA,B,C,D2VCX0.77
GSHGLUTATHIONEA,B,C,D1XW60.77
GSHGLUTATHIONEA3CRU0.77
GSHGLUTATHIONEA,B1B480.77
GSHGLUTATHIONEA2ZK20.77
GSHGLUTATHIONEA,B,C,D1IYH0.77
GSHGLUTATHIONEA,B,C,D1Q8M0.77
GSHGLUTATHIONEA,B,C,D2PBJ0.77
GSHGLUTATHIONEA,B,C,D2VCQ0.77
GSHGLUTATHIONEA1GRA0.77
GSHGLUTATHIONEA,B1QGJ0.77
GSHGLUTATHIONEA2HGS0.77
GSHGLUTATHIONEA,B,C,D2VD10.77
GSHGLUTATHIONEA1ZHM0.77
GSHGLUTATHIONEA,B,C,D2VCZ0.77
GSHGLUTATHIONEC1KCG0.77
GSHGLUTATHIONEA,B1MD30.77
GSHGLUTATHIONEA,B2IO90.77
GSHGLUTATHIONEA,B2JL40.77
GSHGLUTATHIONEA3DK80.77
GSHGLUTATHIONEA3DK40.77
GSHGLUTATHIONEA,B,D2VCW0.77
GSHGLUTATHIONEA,B1XW50.77
GSHGLUTATHIONEA,B3FHS0.77
GSHGLUTATHIONEA,B1Y1A0.77
GSHGLUTATHIONEA1GRE0.77
GSHGLUTATHIONEA,B2HT90.77
GSHGLUTATHIONEA,B1DUG0.77
GSHGLUTATHIONEA,B,C,D2VD00.77
GSHGLUTATHIONEA,B1TYP0.77
GSHGLUTATHIONEA2FLS0.77
GSHGLUTATHIONEA,B1OE80.77
GSHGLUTATHIONEA,B1PX70.77
GSHGLUTATHIONEA3C1S0.77
GSHGLUTATHIONEA,B1F3A0.77
GSHGLUTATHIONEA1FW10.77
GSHGLUTATHIONEA,B2IMI0.77
GSHGLUTATHIONEA,B1LBK0.77
GSHGLUTATHIONEA,B2HQM0.77
GSHGLUTATHIONEA,B1TDI0.77
GSHGLUTATHIONEA,B,C,D1V400.77
GSHGLUTATHIONEA,B,C,D1IYI0.77
GSHGLUTATHIONEA3D0Z0.77
GSHGLUTATHIONEA,B1ZGN0.77
GSHGLUTATHIONEA,B,C,D2CVD0.77
GSHGLUTATHIONEA,B3C8E0.77
GSHGLUTATHIONEA,B,C1YJ60.77
GSHGLUTATHIONEA2IMD0.77
GSHGLUTATHIONEA2IME0.77
GSHGLUTATHIONEA3BHJ0.77
GSHGLUTATHIONEA,B1OE70.77
GSN2-AMINO-5-[1-(CARBOXYLATOMETHYLCARBAMOYL)-
2-NITROSOSULFANYL-ETHYL]AMINO-5-
OXO-PENTANOATE
A,B2A2S0.79
GSN2-AMINO-5-[1-(CARBOXYLATOMETHYLCARBAMOYL)-
2-NITROSOSULFANYL-ETHYL]AMINO-5-
OXO-PENTANOATE
A,B2A2R0.79
MEQN5-METHYLGLUTAMINEA,B1NV80.77
GGAD-GAMMA-GLUTAMYL-N-{[(R)-{4-[(4-
AMINOBUTYL)AMINO]BUTYL}(PHOSPHONOOXY)PHOSPHORYL]METHYL}-
D-ALANINAMIDE
A,B2IOA0.7
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA4GRT0.71
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA,B1BZL0.71
GIOCYCLO-(GLYCINE-L-PROLINE) INHIBITORA,B1W1P0.71
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.75