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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00467724

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2NHN-ACETYL-S-[(2E,6E)-3,7,11-TRIMETHYLDODECA-
2,6,10-TRIENYL]-L-CYSTEINYL-D-VALYL-
L-ISOLEUCYL-L-METHIONINE
B1O1T0.72
AFJ(2R,4S,5S)-N-butyl-4-hydroxy-2,7-
dimethyl-5-{[N-(4-methylpentanoyl)-
L-methionyl]amino}octanamide
A,B,C3DUY0.78
GTYL-GAMMA-GLUTAMYL-S-OCTYL-D-CYSTEINYLGLYCINEA1U880.77
HEL(2S,5R,6R)-6-{[(6R)-6-(GLYCYLAMINO)-
7-OXIDO-7-OXOHEPTANOYL]AMINO}-3,3-
DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLATE
A1PWG0.76
HEL(2S,5R,6R)-6-{[(6R)-6-(GLYCYLAMINO)-
7-OXIDO-7-OXOHEPTANOYL]AMINO}-3,3-
DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLATE
A1PW10.76
EPMN-PALMITOYL-L-METHIONINEA,B1ZO90.8
BH7E-AMINO BIOTINYL CAPROIC ACIDA,B1LCZ0.73
BH7E-AMINO BIOTINYL CAPROIC ACIDA,B1LEL0.73
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
IP1ISOPENICILLIN NA1QJE0.78
CYKN-hexanoyl-L-homocysteineA3DHC0.73
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.73
HJ3(2R,4S)-2-[(1R)-1-{[(6S)-6-amino-
6-carboxyhexanoyl]amino}-2-oxoethyl]-
5,5-dimethyl-1,3-thiazolidine-4-
carboxylic acid
A3BEB0.82
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.79
A14(1S,4S,5S,7R)-7-{[(5S)-5-AMINO-
5-CARBOXYPENTANOYL]AMINO}-3,3-DIMETHYL-
6-OXO-2-THIABICYCLO[3.2.0]HEPTANE-
4-CARBOXYLIC ACID
A2JB40.75
VB1N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}-
2-oxo-1-(sulfanylmethyl)ethyl]-
6-oxo-L-lysine
A2VBP0.77
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W050.77
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W060.77
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRK0.7
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRL0.7
BB2ACTINONINA,B,C,D3G5K0.7
BB2ACTINONINA,B,C1LRU0.7
BB2ACTINONINA,B2OKL0.7
BB2ACTINONINA2OS10.7
BB2ACTINONINA,B,C1G2A0.7
BB2ACTINONINA1Q1Y0.7
BB2ACTINONINA,B,C,D,E,F,
G,H
1SZZ0.7
BB2ACTINONINA1LQY0.7
BB2ACTINONINA2OS30.7
BB2ACTINONINA1LRY0.7
BB2ACTINONINA,B1IX10.7
BB2ACTINONINA1WS10.7
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
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.71
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.71
HFVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-L-3,3,3,3',3',3'-HEXAFLUOROVALINE
A2BU90.75
HT5(4S)-4-(decanoylamino)-5-hydroxy-
3,4-dihydro-2H-thiophenium
A,B,C,D2VC70.71
APV6-(5-AMINO-5-CARBOXY-PENTANOYLAMINO)-
3-HYDROXYMETHYL-7-OXO-4-THIA-1-
AZA-BICYCLO[3.2.0]HEPTANE-2-CARBOXYLIC ACID
A1ODN0.7
GTXS-HEXYLGLUTATHIONEA,B1K3Y0.78
GTXS-HEXYLGLUTATHIONEA,B1AGS0.78
GTXS-HEXYLGLUTATHIONEA,B1PN90.78
GTXS-HEXYLGLUTATHIONEA,B1Q4J0.78
GTXS-HEXYLGLUTATHIONEA,B2IMK0.78
GTXS-HEXYLGLUTATHIONEA,B4GSS0.78
GTXS-HEXYLGLUTATHIONEA,B,C1GWC0.78
GTXS-HEXYLGLUTATHIONEA,B,C,D2C3Q0.78
GTXS-HEXYLGLUTATHIONEA,B,C,D1TU80.78
GTXS-HEXYLGLUTATHIONEA,B2GLR0.78
GTXS-HEXYLGLUTATHIONEA,B2OA70.78
GTXS-HEXYLGLUTATHIONEA,C2AAW0.78
GTXS-HEXYLGLUTATHIONEA,B1VF20.78
GTXS-HEXYLGLUTATHIONEA1M9A0.78
GTXS-HEXYLGLUTATHIONEA,B17GS0.78
GTXS-HEXYLGLUTATHIONEA,B1K0A0.78
GTXS-HEXYLGLUTATHIONEA,B2R3X0.78
GTXS-HEXYLGLUTATHIONEA,B1GSU0.78
GTXS-HEXYLGLUTATHIONEA,B2C800.78
GTXS-HEXYLGLUTATHIONEA,B2R6K0.78
GTXS-HEXYLGLUTATHIONEA,B1PGT0.78
GTXS-HEXYLGLUTATHIONEA,B2J9H0.78
GTXS-HEXYLGLUTATHIONEA,B1K3L0.78
GTXS-HEXYLGLUTATHIONEA,B1GNW0.78
GTXS-HEXYLGLUTATHIONEA,B,C,D1BH50.78
GTXS-HEXYLGLUTATHIONEA,B1YDK0.78
GTXS-HEXYLGLUTATHIONEA,B9GSS0.78
AUAA,B,C1YM20.7
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.76
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.72
TGGGAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINEA2F2K0.71
TGGGAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINEA,B2V6K0.71
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W030.76
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W040.76
ABX5-[1-(ACETYLAMINO)-3-METHYLBUTYL]-
4-(METHOXYCARBONYL)PROLINE
A1XOE0.71
LASN-acetyl-S-({(2R,3S,4R)-3-hydroxy-
2-[(1S)-1-hydroxy-2-methylpropyl]-
4-methyl-5-oxopyrrolidin-2-yl}carbonyl)cysteine
A,B3DPM0.77
ACWD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
B-METHYL-D-CYCLOPROPYLGLYCINE
B2IVI0.77
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.8
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.8
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.8
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.8
HJ2(2R)-2-[(R)-{[(6S)-6-amino-6-carboxyhexanoyl]amino}(carboxy)methyl]-
5-methyl-3,6-dihydro-2H-1,3-thiazine-
4-carboxylic acid
A3BEC0.71
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.77
ACS1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-
(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-
(4R)-SULFANYLAZETIDIN-2-ONE
A1QJF0.73
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
CDHD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-ISODEHYDROVALINE
A1UZW0.71
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
RCYS-[(3S,3'R)-1'-hydroxy-2',2',5',5'-
tetramethyl-2,5-dioxo-1,3'-bipyrrolidin-
3-yl]-L-cysteine
A2JU40.72