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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02413876

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.7
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.7
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.7
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.7
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
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.79
GSHGLUTATHIONEA1EEM0.79
GSHGLUTATHIONEA,B1USB0.79
GSHGLUTATHIONEA3FZA0.79
GSHGLUTATHIONEA2IMF0.79
GSHGLUTATHIONEA,B1PX60.79
GSHGLUTATHIONEA,B1MD40.79
GSHGLUTATHIONEA2CZ20.79
GSHGLUTATHIONEA3FZ90.79
GSHGLUTATHIONEA,B,C,D1R4W0.79
GSHGLUTATHIONEA1ZHP0.79
GSHGLUTATHIONEA,B3E730.79
GSHGLUTATHIONEA1VF10.79
GSHGLUTATHIONEA3CRT0.79
GSHGLUTATHIONEA,B,C,D2VCX0.79
GSHGLUTATHIONEA,B,C,D1XW60.79
GSHGLUTATHIONEA3CRU0.79
GSHGLUTATHIONEA,B1B480.79
GSHGLUTATHIONEA2ZK20.79
GSHGLUTATHIONEA,B,C,D1IYH0.79
GSHGLUTATHIONEA,B,C,D1Q8M0.79
GSHGLUTATHIONEA,B,C,D2PBJ0.79
GSHGLUTATHIONEA,B,C,D2VCQ0.79
GSHGLUTATHIONEA1GRA0.79
GSHGLUTATHIONEA,B1QGJ0.79
GSHGLUTATHIONEA2HGS0.79
GSHGLUTATHIONEA,B,C,D2VD10.79
GSHGLUTATHIONEA1ZHM0.79
GSHGLUTATHIONEA,B,C,D2VCZ0.79
GSHGLUTATHIONEC1KCG0.79
GSHGLUTATHIONEA,B1MD30.79
GSHGLUTATHIONEA,B2IO90.79
GSHGLUTATHIONEA,B2JL40.79
GSHGLUTATHIONEA3DK80.79
GSHGLUTATHIONEA3DK40.79
GSHGLUTATHIONEA,B,D2VCW0.79
GSHGLUTATHIONEA,B1XW50.79
GSHGLUTATHIONEA,B3FHS0.79
GSHGLUTATHIONEA,B1Y1A0.79
GSHGLUTATHIONEA1GRE0.79
GSHGLUTATHIONEA,B2HT90.79
GSHGLUTATHIONEA,B1DUG0.79
GSHGLUTATHIONEA,B,C,D2VD00.79
GSHGLUTATHIONEA,B1TYP0.79
GSHGLUTATHIONEA2FLS0.79
GSHGLUTATHIONEA,B1OE80.79
GSHGLUTATHIONEA,B1PX70.79
GSHGLUTATHIONEA3C1S0.79
GSHGLUTATHIONEA,B1F3A0.79
GSHGLUTATHIONEA1FW10.79
GSHGLUTATHIONEA,B2IMI0.79
GSHGLUTATHIONEA,B1LBK0.79
GSHGLUTATHIONEA,B2HQM0.79
GSHGLUTATHIONEA,B1TDI0.79
GSHGLUTATHIONEA,B,C,D1V400.79
GSHGLUTATHIONEA,B,C,D1IYI0.79
GSHGLUTATHIONEA3D0Z0.79
GSHGLUTATHIONEA,B1ZGN0.79
GSHGLUTATHIONEA,B,C,D2CVD0.79
GSHGLUTATHIONEA,B3C8E0.79
GSHGLUTATHIONEA,B,C1YJ60.79
GSHGLUTATHIONEA2IMD0.79
GSHGLUTATHIONEA2IME0.79
GSHGLUTATHIONEA3BHJ0.79
GSHGLUTATHIONEA,B1OE70.79
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W050.73
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W060.73
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W030.74
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W040.74
BG33-METHYL-5-SULFO-PYRROLIDINE-2-
CARBOXYLIC ACID
A1TV40.7
MUDN-{[(1R)-1-carboxy-2-(methylsulfanyl)ethyl]carbamoyl}-
L-glutamic acid
A3D7G0.72
VB1N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}-
2-oxo-1-(sulfanylmethyl)ethyl]-
6-oxo-L-lysine
A2VBP0.73
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.75
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.75
IP1ISOPENICILLIN NA1QJE0.74
GTXS-HEXYLGLUTATHIONEA,B1K3Y0.82
GTXS-HEXYLGLUTATHIONEA,B1AGS0.82
GTXS-HEXYLGLUTATHIONEA,B1PN90.82
GTXS-HEXYLGLUTATHIONEA,B1Q4J0.82
GTXS-HEXYLGLUTATHIONEA,B2IMK0.82
GTXS-HEXYLGLUTATHIONEA,B4GSS0.82
GTXS-HEXYLGLUTATHIONEA,B,C1GWC0.82
GTXS-HEXYLGLUTATHIONEA,B,C,D2C3Q0.82
GTXS-HEXYLGLUTATHIONEA,B,C,D1TU80.82
GTXS-HEXYLGLUTATHIONEA,B2GLR0.82
GTXS-HEXYLGLUTATHIONEA,B2OA70.82
GTXS-HEXYLGLUTATHIONEA,C2AAW0.82
GTXS-HEXYLGLUTATHIONEA,B1VF20.82
GTXS-HEXYLGLUTATHIONEA1M9A0.82
GTXS-HEXYLGLUTATHIONEA,B17GS0.82
GTXS-HEXYLGLUTATHIONEA,B1K0A0.82
GTXS-HEXYLGLUTATHIONEA,B2R3X0.82
GTXS-HEXYLGLUTATHIONEA,B1GSU0.82
GTXS-HEXYLGLUTATHIONEA,B2C800.82
GTXS-HEXYLGLUTATHIONEA,B2R6K0.82
GTXS-HEXYLGLUTATHIONEA,B1PGT0.82
GTXS-HEXYLGLUTATHIONEA,B2J9H0.82
GTXS-HEXYLGLUTATHIONEA,B1K3L0.82
GTXS-HEXYLGLUTATHIONEA,B1GNW0.82
GTXS-HEXYLGLUTATHIONEA,B,C,D1BH50.82
GTXS-HEXYLGLUTATHIONEA,B1YDK0.82
GTXS-HEXYLGLUTATHIONEA,B9GSS0.82
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.81
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.81
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA4GRT0.72
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA,B1BZL0.72
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.75
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.75
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.75
GTYL-GAMMA-GLUTAMYL-S-OCTYL-D-CYSTEINYLGLYCINEA1U880.79
APV6-(5-AMINO-5-CARBOXY-PENTANOYLAMINO)-
3-HYDROXYMETHYL-7-OXO-4-THIA-1-
AZA-BICYCLO[3.2.0]HEPTANE-2-CARBOXYLIC ACID
A1ODN0.72
HJ3(2R,4S)-2-[(1R)-1-{[(6S)-6-amino-
6-carboxyhexanoyl]amino}-2-oxoethyl]-
5,5-dimethyl-1,3-thiazolidine-4-
carboxylic acid
A3BEB0.74
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.75
ACS1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-
(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-
(4R)-SULFANYLAZETIDIN-2-ONE
A1QJF0.74
GTTGLUTATHIONEA,B11GS0.79
GTTGLUTATHIONEA1GSN0.79
GTTGLUTATHIONEA,C1K0B0.79
GTTGLUTATHIONEA,B,C1K0D0.79
GTTGLUTATHIONEA,B6GSY0.79
GTTGLUTATHIONEA,B19GS0.79
GTTGLUTATHIONEA1FLJ0.79
GTTGLUTATHIONEA,B3DD30.79
GTTGLUTATHIONEA2PVQ0.79
GTTGLUTATHIONEA1DNC0.79
GTTGLUTATHIONEA,B,C,D,E,F,
G,H,I,J,K,L
2PNO0.79
GTTGLUTATHIONEA,B,C,D3CSI0.79
GTTGLUTATHIONEA,B6GSS0.79
GTTGLUTATHIONEA2R4V0.79
GTTGLUTATHIONEA,B,C,D3FZ50.79
GTTGLUTATHIONEA,B3GSS0.79
GTTGLUTATHIONEA,B2F8F0.79
GTTGLUTATHIONEA,B1GSY0.79
GTTGLUTATHIONEA1PMT0.79
GTTGLUTATHIONEA,B1GSE0.79
GTTGLUTATHIONEA,B,C,D1F2E0.79
GTTGLUTATHIONEA1UW30.79
GTTGLUTATHIONEA,B1SS40.79
GTTGLUTATHIONEA,B5GSS0.79
GTTGLUTATHIONEA1GRX0.79
GTTGLUTATHIONEA,B7GSS0.79
GTTGLUTATHIONEA1UA50.79
GTTGLUTATHIONEA,B,C8GSS0.79
GTTGLUTATHIONEA,B1LJR0.79
GTTGLUTATHIONEA,B,C,D1OYJ0.79
GTTGLUTATHIONEA,B,C,D2E7P0.79
GTTGLUTATHIONEA,B,C,D,E,F2GDR0.79
GTTGLUTATHIONEA,B,C,D2WEM0.79
GTTGLUTATHIONEA,B1K0A0.79
GTTGLUTATHIONEA,B3EE20.79
GTTGLUTATHIONEA3G5S0.79
GTTGLUTATHIONEA1HNL0.79
GTTGLUTATHIONEA,B,C,D1K0C0.79
GTTGLUTATHIONEA,B6GST0.79
GTTGLUTATHIONEA,B1TU70.79
GTTGLUTATHIONEA2H8A0.79
GTTGLUTATHIONEA,B,C,D2PMT0.79
GTTGLUTATHIONEA2UUH0.79
GTTGLUTATHIONEA,B1ZL90.79
GTTGLUTATHIONEA,B1QH50.79
GTTGLUTATHIONE1,21PD20.79
GTTGLUTATHIONEA,B3CSH0.79
GTTGLUTATHIONEA,C1JZR0.79
GTTGLUTATHIONEA2NTO0.79
GTTGLUTATHIONEA,B1KBN0.79
GTTGLUTATHIONEA3GRX0.79
GTTGLUTATHIONEA1B4Q0.79
GTTGLUTATHIONEA,B1PKW0.79
GTTGLUTATHIONEA1K0N0.79
GTTGLUTATHIONEA,B,C,D2DSA0.79
GTTGLUTATHIONEA,B2HNL0.79
GTTGLUTATHIONEA,B,C,D,E,F,
G,H
2ON50.79
GTTGLUTATHIONEA1GSA0.79
TS4GLUTATHIONYLSPERMIDINE DISULFIDEA5GRT0.72
TS5GLUTATHIONYLSPERMIDINEA1I5G0.74
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.82
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1FHE0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CA80.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1GNE0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B3D5J0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H
2VCR0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2WCI0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1OYJ0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U3I0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1XA80.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2BRQ0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CAQ0.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U870.79
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B1M0U0.79
GTSGLUTATHIONE SULFONIC ACIDA,B1A0F0.8
GTSGLUTATHIONE SULFONIC ACIDA,B1GLP0.8
GTSGLUTATHIONE SULFONIC ACIDA,B1N2A0.8
GTSGLUTATHIONE SULFONIC ACIDA,B,C,D1V2A0.8
GTSGLUTATHIONE SULFONIC ACIDA1M990.8
GTSGLUTATHIONE SULFONIC ACIDA1R5A0.8
GTSGLUTATHIONE SULFONIC ACIDA,C,D1EV90.8
GTSGLUTATHIONE SULFONIC ACIDA,C,D1EV40.8
GSFL-GAMMA-GLUTAMYL-3-SULFINO-L-ALANYLGLYCINEA,B1YZX0.8
TGGGAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINEA2F2K0.81
TGGGAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINEA,B2V6K0.81
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
A3GRT0.73
DDD(5R,10S)-5-{[(CARBOXYMETHYL)AMINO]CARBONYL}-
7-OXO-3-THIA-1,6-DIAZABICYCLO[4.4.1]UNDECANE-
10-CARBOXYLIC ACID
A2PFG0.72