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Compile Data Set for Download or QSAR

Found 106 hits Enz. Inhib. hit(s) with Target = 'Galectin-1' AND taxid = 9606   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Galectin-1


(Homo sapiens (human))
BDBM50272418
PNG
((2S,3R,4S,5R,6R)-2-((2R,3S,4R,5R,6S)-6-((1-((2S,3S...)
Show SMILES OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](SCc3cn(nn3)[C@H]3O[C@@H](CO)[C@H](O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C27H45N3O20S/c31-2-8-12(35)14(37)19(42)25(46-8)49-22-10(4-33)45-24(18(41)16(22)39)30-1-7(28-29-30)6-51-27-21(44)17(40)23(11(5-34)48-27)50-26-20(43)15(38)13(36)9(3-32)47-26/h1,8-27,31-44H,2-6H2/t8-,9+,10-,11+,12+,13-,14+,15-,16-,17+,18-,19-,20+,21+,22-,23+,24-,25+,26-,27-/m0/s1
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
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PubMed
n/an/a 3.00E+5n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272419
PNG
((2S,3R,4S,5R,6R)-2-((1-((2S,3S,4S,5R,6S)-3,4-dihyd...)
Show SMILES OC[C@@H]1O[C@H](O[C@H]2[C@H](CO)O[C@@H]([C@@H](O)[C@@H]2O)n2cc(CS[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nn2)[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C21H35N3O15S/c25-2-7-10(28)12(30)16(34)20(37-7)39-18-9(4-27)36-19(15(33)14(18)32)24-1-6(22-23-24)5-40-21-17(35)13(31)11(29)8(3-26)38-21/h1,7-21,25-35H,2-5H2/t7-,8+,9-,10+,11-,12+,13-,14-,15-,16-,17+,18-,19-,20+,21-/m0/s1
PDB
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n/an/a 3.00E+5n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272383
PNG
((2S,3R,4R,5R,6R)-2-(3-(4-(3-((2R,3S,4S,5R,6S)-3,4-...)
Show SMILES CC(=O)O[C@@H]1[C@@H](O)[C@@H](O[C@H](CO)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)SCC#Cc1ccc(cc1)C#CCS[C@H]1O[C@@H](CO)[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C38H52O21S2/c1-16(43)53-34-31(52)38(57-22(15-42)33(34)59-36-29(50)26(47)24(45)20(13-40)55-36)61-11-3-5-18-8-6-17(7-9-18)4-2-10-60-37-30(51)27(48)32(21(14-41)56-37)58-35-28(49)25(46)23(44)19(12-39)54-35/h6-9,19-42,44-52H,10-15H2,1H3/t19-,20+,21-,22+,23+,24-,25+,26-,27-,28-,29+,30-,31+,32-,33+,34+,35+,36-,37+,38-/m0/s1
PDB
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KEGG

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n/an/a 3.00E+5n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272380
PNG
((2S,3R,4S,5R,6R)-2-((2R,3S,4R,5R,6S)-6-(6-((2R,3S,...)
Show SMILES OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](SCC#CC#CCS[C@H]3O[C@@H](CO)[C@H](O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C30H46O20S2/c31-7-11-15(35)17(37)21(41)27(45-11)49-25-13(9-33)47-29(23(43)19(25)39)51-5-3-1-2-4-6-52-30-24(44)20(40)26(14(10-34)48-30)50-28-22(42)18(38)16(36)12(8-32)46-28/h11-44H,5-10H2/t11-,12+,13-,14+,15+,16-,17+,18-,19-,20+,21-,22+,23-,24+,25-,26+,27+,28-,29+,30-
PDB
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n/an/a 3.00E+5n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272206
PNG
((E)-Methyl 2-phenyl-4-(beta-D-galactopyranosyl)-bu...)
Show SMILES COC(=O)\C=C(/C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)c1ccccc1
Show InChI InChI=1S/C17H22O7/c1-23-14(19)8-11(10-5-3-2-4-6-10)7-12-15(20)17(22)16(21)13(9-18)24-12/h2-6,8,12-13,15-18,20-22H,7,9H2,1H3/b11-8+/t12-,13+,15-,16-,17+/m0/s1
PDB
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n/an/a 3.13E+5n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272381
PNG
((2S,3R,4S,5R,6R)-2-((2R,3S,4R,5R,6S)-4,5-dihydroxy...)
Show SMILES OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](SCC#C)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C15H24O10S/c1-2-3-26-15-12(22)10(20)13(7(5-17)24-15)25-14-11(21)9(19)8(18)6(4-16)23-14/h1,6-22H,3-5H2/t6-,7-,8+,9+,10-,11-,12-,13-,14+,15+/m1/s1
PDB
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n/an/a 6.00E+5n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272379
PNG
((2S,3R,4S,5R,6R)-2-((2R,3S,4R,5R,6S)-4,5-dihydroxy...)
Show SMILES OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](SCc3cn(nn3)[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C21H35N3O15S/c25-2-7-10(28)12(30)15(33)19(36-7)24-1-6(22-23-24)5-40-21-17(35)14(32)18(9(4-27)38-21)39-20-16(34)13(31)11(29)8(3-26)37-20/h1,7-21,25-35H,2-5H2/t7-,8+,9+,10+,11-,12+,13-,14+,15-,16+,17+,18+,19-,20-,21-/m0/s1
PDB
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n/an/a 6.00E+5n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50370453
PNG
(LACTOSE | Lactose, anhydrous)
Show SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1
PDB
MMDB

NCI pathway
KEGG

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MMDB
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Article
PubMed
n/an/a 8.00E+5n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Galectin-1


(Homo sapiens (human))
BDBM50272303
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-4-nitrobenz...)
Show SMILES Cc1nc(NCc2ccc(cc2)[N+]([O-])=O)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C18H23N3O7S/c1-9-14(6-12-15(23)17(25)16(24)13(8-22)28-12)29-18(20-9)19-7-10-2-4-11(5-3-10)21(26)27/h2-5,12-13,15-17,22-25H,6-8H2,1H3,(H,19,20)/t12-,13+,15-,16-,17+/m0/s1
PDB
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n/an/a 2.50E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272334
PNG
(2-p-Bromobenzamido-5-(beta-D-galactopyranosyl)-4-m...)
Show SMILES Cc1nc(NC(=O)c2ccc(Br)cc2)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C18H21BrN2O6S/c1-8-13(6-11-14(23)16(25)15(24)12(7-22)27-11)28-18(20-8)21-17(26)9-2-4-10(19)5-3-9/h2-5,11-12,14-16,22-25H,6-7H2,1H3,(H,20,21,26)/t11-,12+,14-,15-,16+/m0/s1
PDB
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n/an/a 2.50E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272384
PNG
((2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(3-(4-(3-((2R...)
Show SMILES OC[C@H]1O[C@@H](SCC#Cc2ccc(cc2)C#CCS[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C24H30O10S2/c25-11-15-17(27)19(29)21(31)23(33-15)35-9-1-3-13-5-7-14(8-6-13)4-2-10-36-24-22(32)20(30)18(28)16(12-26)34-24/h5-8,15-32H,9-12H2/t15-,16+,17+,18-,19+,20-,21-,22+,23+,24-
PDB
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n/an/a 2.50E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272301
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-(2,5-dibrom...)
Show SMILES Cc1nc(NS(=O)(=O)c2cc(Br)ccc2Br)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C17H20Br2N2O7S2/c1-7-12(5-10-14(23)16(25)15(24)11(6-22)28-10)29-17(20-7)21-30(26,27)13-4-8(18)2-3-9(13)19/h2-4,10-11,14-16,22-25H,5-6H2,1H3,(H,20,21)/t10-,11+,14-,15-,16+/m0/s1
PDB
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272151
PNG
((2R,3R,4R,5R,6S,E)-2-(hydroxymethyl)-6-(prop-1-eny...)
Show SMILES C\C=C\[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C9H16O5/c1-2-3-5-7(11)9(13)8(12)6(4-10)14-5/h2-3,5-13H,4H2,1H3/b3-2+/t5-,6+,7-,8-,9+/m0/s1
PDB
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272420
PNG
((2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-((1-((2S,3S,4...)
Show SMILES OC[C@H]1O[C@@H](SCc2cn(nn2)[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C15H25N3O10S/c19-2-6-8(21)10(23)12(25)14(27-6)18-1-5(16-17-18)4-29-15-13(26)11(24)9(22)7(3-20)28-15/h1,6-15,19-26H,2-4H2/t6-,7+,8+,9-,10+,11-,12-,13+,14-,15-/m0/s1
PDB
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272417
PNG
(CHEMBL522064 | Dimeric galactoside)
Show SMILES OC[C@H]1O[C@@H](SCC#CC#CCS[C@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C18H26O10S2/c19-7-9-11(21)13(23)15(25)17(27-9)29-5-3-1-2-4-6-30-18-16(26)14(24)12(22)10(8-20)28-18/h9-26H,5-8H2/t9-,10+,11+,12-,13-,14-,15-,16+,17+,18-/m0/s1
PDB
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KEGG

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PubMed
n/an/a 5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272382
PNG
((2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(prop-2-ynylt...)
Show SMILES OC[C@H]1O[C@@H](SCC#C)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C9H14O5S/c1-2-3-15-9-8(13)7(12)6(11)5(4-10)14-9/h1,5-13H,3-4H2/t5-,6+,7+,8-,9+/m1/s1
PDB
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Galectin-1


(Homo sapiens (human))
BDBM50272378
PNG
(5-(beta-D-Galactopyranosyl)-2-methylcarbamate-4-me...)
Show SMILES COC(=O)Nc1nc(C)c(C[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)s1
Show InChI InChI=1S/C13H20N2O7S/c1-5-8(23-12(14-5)15-13(20)21-2)3-6-9(17)11(19)10(18)7(4-16)22-6/h6-7,9-11,16-19H,3-4H2,1-2H3,(H,14,15,20)/t6-,7+,9-,10-,11+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272336
PNG
(2-Acetamido-5-(beta-D-galactopyranosyl)-4-methylth...)
Show SMILES CC(=O)Nc1nc(C)c(C[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)s1
Show InChI InChI=1S/C13H20N2O6S/c1-5-9(22-13(14-5)15-6(2)17)3-7-10(18)12(20)11(19)8(4-16)21-7/h7-8,10-12,16,18-20H,3-4H2,1-2H3,(H,14,15,17)/t7-,8+,10-,11-,12+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272335
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-phenylaceta...)
Show SMILES Cc1nc(NC(=O)Cc2ccccc2)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C19H24N2O6S/c1-10-14(8-12-16(24)18(26)17(25)13(9-22)27-12)28-19(20-10)21-15(23)7-11-5-3-2-4-6-11/h2-6,12-13,16-18,22,24-26H,7-9H2,1H3,(H,20,21,23)/t12-,13+,16-,17-,18+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272302
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-benzylamino...)
Show SMILES Cc1nc(NCc2ccccc2)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C18H24N2O5S/c1-10-14(7-12-15(22)17(24)16(23)13(9-21)25-12)26-18(20-10)19-8-11-5-3-2-4-6-11/h2-6,12-13,15-17,21-24H,7-9H2,1H3,(H,19,20)/t12-,13+,15-,16-,17+/m0/s1
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n/an/a 5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272204
PNG
((2S,3R,4R,5R,6R)-2-cinnamyl-6-(hydroxymethyl)-tetr...)
Show SMILES OC[C@H]1O[C@@H](C\C=C\c2ccccc2)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C15H20O5/c16-9-12-14(18)15(19)13(17)11(20-12)8-4-7-10-5-2-1-3-6-10/h1-7,11-19H,8-9H2/b7-4+/t11-,12+,13-,14-,15+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272205
PNG
((E)-Methyl 4-(beta-D-galactopyranosyl)-but-2-enoat...)
Show SMILES COC(=O)\C=C\C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C11H18O7/c1-17-8(13)4-2-3-6-9(14)11(16)10(15)7(5-12)18-6/h2,4,6-7,9-12,14-16H,3,5H2,1H3/b4-2+/t6-,7+,9-,10-,11+/m0/s1
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n/an/a 5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272207
PNG
((2S,3R,4R,5R,6R)-2-((12S,14R,15R,16R,17R,E)-3-((E)...)
Show SMILES OC[C@H]1O[C@@H](C\C=C\c2cccc(\C=C\C[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c2)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C24H34O10/c25-11-17-21(29)23(31)19(27)15(33-17)8-2-6-13-4-1-5-14(10-13)7-3-9-16-20(28)24(32)22(30)18(12-26)34-16/h1-7,10,15-32H,8-9,11-12H2/b6-2+,7-3+/t15-,16-,17+,18+,19-,20-,21-,22-,23+,24+/m0/s1
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n/an/a 5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50255142
PNG
(1-((2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymet...)
Show SMILES CC(=O)C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C9H16O6/c1-4(11)2-5-7(12)9(14)8(13)6(3-10)15-5/h5-10,12-14H,2-3H2,1H3/t5-,6+,7-,8-,9+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272208
PNG
((2R,3R,4R,5R,6S)-2-(hydroxymethyl)-6-(2-(4-methoxy...)
Show SMILES COc1ccc(cc1)C(=C)C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C16H22O6/c1-9(10-3-5-11(21-2)6-4-10)7-12-14(18)16(20)15(19)13(8-17)22-12/h3-6,12-20H,1,7-8H2,2H3/t12-,13+,14-,15-,16+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272258
PNG
((2R,3R,4R,5R,6S)-2-(hydroxymethyl)-6-(2-(3-nitroph...)
Show SMILES OC[C@H]1O[C@@H](CC(=C)c2cccc(c2)[N+]([O-])=O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C15H19NO7/c1-8(9-3-2-4-10(6-9)16(21)22)5-11-13(18)15(20)14(19)12(7-17)23-11/h2-4,6,11-15,17-20H,1,5,7H2/t11-,12+,13-,14-,15+/m0/s1
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n/an/a 5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272259
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-(4-methyl-p...)
Show SMILES Cc1nc(NS(=O)(=O)c2ccc(C)cc2)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C18H24N2O7S2/c1-9-3-5-11(6-4-9)29(25,26)20-18-19-10(2)14(28-18)7-12-15(22)17(24)16(23)13(8-21)27-12/h3-6,12-13,15-17,21-24H,7-8H2,1-2H3,(H,19,20)/t12-,13+,15-,16-,17+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272260
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-(4-bromophe...)
Show SMILES Cc1nc(NS(=O)(=O)c2ccc(Br)cc2)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C17H21BrN2O7S2/c1-8-13(6-11-14(22)16(24)15(23)12(7-21)27-11)28-17(19-8)20-29(25,26)10-4-2-9(18)3-5-10/h2-5,11-12,14-16,21-24H,6-7H2,1H3,(H,19,20)/t11-,12+,14-,15-,16+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272261
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-(b-naphthyl...)
Show SMILES Cc1nc(NS(=O)(=O)c2ccc3ccccc3c2)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C21H24N2O7S2/c1-11-17(9-15-18(25)20(27)19(26)16(10-24)30-15)31-21(22-11)23-32(28,29)14-7-6-12-4-2-3-5-13(12)8-14/h2-8,15-16,18-20,24-27H,9-10H2,1H3,(H,22,23)/t15-,16+,18-,19-,20+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272262
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-(2-chloro-p...)
Show SMILES Cc1nc(NS(=O)(=O)c2ccccc2Cl)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C17H21ClN2O7S2/c1-8-12(6-10-14(22)16(24)15(23)11(7-21)27-10)28-17(19-8)20-29(25,26)13-5-3-2-4-9(13)18/h2-5,10-11,14-16,21-24H,6-7H2,1H3,(H,19,20)/t10-,11+,14-,15-,16+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272300
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-(4-tert-But...)
Show SMILES Cc1nc(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C21H30N2O7S2/c1-11-16(9-14-17(25)19(27)18(26)15(10-24)30-14)31-20(22-11)23-32(28,29)13-7-5-12(6-8-13)21(2,3)4/h5-8,14-15,17-19,24-27H,9-10H2,1-4H3,(H,22,23)/t14-,15+,17-,18-,19+/m0/s1
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n/an/a 5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272333
PNG
(2-p-Anisamido-5-(beta-D-galactopyranosyl)-4-methyl...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(C)c(C[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)s1
Show InChI InChI=1S/C19H24N2O7S/c1-9-14(7-12-15(23)17(25)16(24)13(8-22)28-12)29-19(20-9)21-18(26)10-3-5-11(27-2)6-4-10/h3-6,12-13,15-17,22-25H,7-8H2,1-2H3,(H,20,21,26)/t12-,13+,15-,16-,17+/m0/s1
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n/an/a 5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272332
PNG
(5-(beta-D-Galactopyranosyl)-4-methyl-2-p-nitro-ben...)
Show SMILES Cc1nc(NC(=O)c2ccc(cc2)[N+]([O-])=O)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C18H21N3O8S/c1-8-13(6-11-14(23)16(25)15(24)12(7-22)29-11)30-18(19-8)20-17(26)9-2-4-10(5-3-9)21(27)28/h2-5,11-12,14-16,22-25H,6-7H2,1H3,(H,19,20,26)/t11-,12+,14-,15-,16+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50272304
PNG
(2-Benzamido-5-(beta-D-galactopyranosyl)-4-methylth...)
Show SMILES Cc1nc(NC(=O)c2ccccc2)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C18H22N2O6S/c1-9-13(7-11-14(22)16(24)15(23)12(8-21)26-11)27-18(19-9)20-17(25)10-5-3-2-4-6-10/h2-6,11-12,14-16,21-24H,7-8H2,1H3,(H,19,20,25)/t11-,12+,14-,15-,16+/m0/s1
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n/an/a>5.00E+6n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50423644
PNG
(GALACTOSE)
Show SMILES OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6+/m1/s1
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n/an/a 5.00E+7n/an/an/an/an/an/a



Universit£ du Qu£bec£ Montr£al

Curated by ChEMBL


Assay Description
Inhibition of recombinant galectin 1 in human O type red blood cells by hemagglutination assay


Bioorg Med Chem 16: 7811-23 (2008)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21519
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-(carbam...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(N)=S)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C16H29N3O10S/c1-5(22)18-9-11(24)13(7(4-21)28-14(9)26-2)29-15-12(25)8(19-16(17)30)10(23)6(3-20)27-15/h6-15,20-21,23-25H,3-4H2,1-2H3,(H,18,22)(H3,17,19,30)/t6-,7-,8+,9-,10+,11-,12-,13-,14-,15+/m1/s1
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n/an/an/a 4.30E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21521
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-3,5-dihyd...)
Show SMILES CNC(=S)N[C@H]1[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)[C@H](OC)O[C@@H]2CO)[C@@H]1O
Show InChI InChI=1S/C17H31N3O10S/c1-6(23)19-10-12(25)14(8(5-22)29-15(10)27-3)30-16-13(26)9(20-17(31)18-2)11(24)7(4-21)28-16/h7-16,21-22,24-26H,4-5H2,1-3H3,(H,19,23)(H2,18,20,31)/t7-,8-,9+,10-,11+,12-,13-,14-,15-,16+/m1/s1
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n/an/an/a 4.90E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21522
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-3,5-dihyd...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)NCC=C)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C19H33N3O10S/c1-4-5-20-19(33)22-11-13(26)9(6-23)30-18(15(11)28)32-16-10(7-24)31-17(29-3)12(14(16)27)21-8(2)25/h4,9-18,23-24,26-28H,1,5-7H2,2-3H3,(H,21,25)(H2,20,22,33)/t9-,10-,11+,12-,13+,14-,15-,16-,17-,18+/m1/s1
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n/an/an/a 3.40E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21523
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-[(butyl...)
Show SMILES CCCCNC(=S)N[C@H]1[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)[C@H](OC)O[C@@H]2CO)[C@@H]1O
Show InChI InChI=1S/C20H37N3O10S/c1-4-5-6-21-20(34)23-12-14(27)10(7-24)31-19(16(12)29)33-17-11(8-25)32-18(30-3)13(15(17)28)22-9(2)26/h10-19,24-25,27-29H,4-8H2,1-3H3,(H,22,26)(H2,21,23,34)/t10-,11-,12+,13-,14+,15-,16-,17-,18-,19+/m1/s1
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n/an/an/a 2.30E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21524
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-[(dieth...)
Show SMILES CCN(CC)C(=S)N[C@H]1[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)[C@H](OC)O[C@@H]2CO)[C@@H]1O
Show InChI InChI=1S/C20H37N3O10S/c1-5-23(6-2)20(34)22-12-14(27)10(7-24)31-19(16(12)29)33-17-11(8-25)32-18(30-4)13(15(17)28)21-9(3)26/h10-19,24-25,27-29H,5-8H2,1-4H3,(H,21,26)(H,22,34)/t10-,11-,12+,13-,14+,15-,16-,17-,18-,19+/m1/s1
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n/an/an/a 4.60E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21525
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-3,5-dihyd...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)NCCO)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C18H33N3O11S/c1-7(25)20-11-13(27)15(9(6-24)31-16(11)29-2)32-17-14(28)10(12(26)8(5-23)30-17)21-18(33)19-3-4-22/h8-17,22-24,26-28H,3-6H2,1-2H3,(H,20,25)(H2,19,21,33)/t8-,9-,10+,11-,12+,13-,14-,15-,16-,17+/m1/s1
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n/an/an/a 4.90E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21526
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-3,5-dihyd...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)NCCCO)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C19H35N3O11S/c1-8(26)21-12-14(28)16(10(7-25)32-17(12)30-2)33-18-15(29)11(13(27)9(6-24)31-18)22-19(34)20-4-3-5-23/h9-18,23-25,27-29H,3-7H2,1-2H3,(H,21,26)(H2,20,22,34)/t9-,10-,11+,12-,13+,14-,15-,16-,17-,18+/m1/s1
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n/an/an/a 2.30E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21527
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-3,5-dihyd...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)Nc3ccccc3)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C22H33N3O10S/c1-10(28)23-15-17(30)19(13(9-27)34-20(15)32-2)35-21-18(31)14(16(29)12(8-26)33-21)25-22(36)24-11-6-4-3-5-7-11/h3-7,12-21,26-27,29-31H,8-9H2,1-2H3,(H,23,28)(H2,24,25,36)/t12-,13-,14+,15-,16+,17-,18-,19-,20-,21+/m1/s1
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n/an/an/a 4.50E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21528
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-[(benzy...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)NCc3ccccc3)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C23H35N3O10S/c1-11(29)25-16-18(31)20(14(10-28)35-21(16)33-2)36-22-19(32)15(17(30)13(9-27)34-22)26-23(37)24-8-12-6-4-3-5-7-12/h3-7,13-22,27-28,30-32H,8-10H2,1-2H3,(H,25,29)(H2,24,26,37)/t13-,14-,15+,16-,17+,18-,19-,20-,21-,22+/m1/s1
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n/an/an/a 3.50E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21529
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-3,5-dihyd...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)NCc3cccnc3)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C22H34N4O10S/c1-10(29)25-15-17(31)19(13(9-28)35-20(15)33-2)36-21-18(32)14(16(30)12(8-27)34-21)26-22(37)24-7-11-4-3-5-23-6-11/h3-6,12-21,27-28,30-32H,7-9H2,1-2H3,(H,25,29)(H2,24,26,37)/t12-,13-,14+,15-,16+,17-,18-,19-,20-,21+/m1/s1
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n/an/an/a 4.30E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21530
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-[(cyclo...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)NC3CCCCC3)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C22H39N3O10S/c1-10(28)23-15-17(30)19(13(9-27)34-20(15)32-2)35-21-18(31)14(16(29)12(8-26)33-21)25-22(36)24-11-6-4-3-5-7-11/h11-21,26-27,29-31H,3-9H2,1-2H3,(H,23,28)(H2,24,25,36)/t12-,13-,14+,15-,16+,17-,18-,19-,20-,21+/m1/s1
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n/an/an/a 4.00E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21531
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-3,5-dihyd...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)N3CCOCC3)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C20H35N3O11S/c1-9(26)21-13-15(28)17(11(8-25)33-18(13)30-2)34-19-16(29)12(14(27)10(7-24)32-19)22-20(35)23-3-5-31-6-4-23/h10-19,24-25,27-29H,3-8H2,1-2H3,(H,21,26)(H,22,35)/t10-,11-,12+,13-,14+,15-,16-,17-,18-,19+/m1/s1
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n/an/an/a 1.60E+5n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21532
PNG
(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-({[(2S,...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)N[C@H]3[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]4[C@H](O)[C@@H](NC(C)=O)[C@H](OC)O[C@@H]4CO)[C@@H]3O)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C31H54N4O20S/c1-9(40)32-17-21(44)25(13(7-38)52-27(17)48-3)54-29-23(46)15(19(42)11(5-36)50-29)34-31(56)35-16-20(43)12(6-37)51-30(24(16)47)55-26-14(8-39)53-28(49-4)18(22(26)45)33-10(2)41/h11-30,36-39,42-47H,5-8H2,1-4H3,(H,32,40)(H,33,41)(H2,34,35,56)/t11-,12-,13-,14-,15+,16+,17-,18-,19+,20+,21-,22-,23-,24-,25-,26-,27-,28-,29+,30+/m1/s1
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n/an/an/a 5.80E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM21533
PNG
(N-[(2R,3R,4R,5S,6R)-4-hydroxy-6-(hydroxymethyl)-2-...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1NC(C)=O
Show InChI InChI=1S/C15H27NO11/c1-5(19)16-8-10(21)13(7(4-18)26-14(8)24-2)27-15-12(23)11(22)9(20)6(3-17)25-15/h6-15,17-18,20-23H,3-4H2,1-2H3,(H,16,19)/t6-,7-,8-,9+,10-,11+,12-,13-,14-,15+/m1/s1
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n/an/an/a 7.00E+4n/an/an/a7.224



Lund University



Assay Description
In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...


Bioorg Med Chem 14: 1215-20 (2006)

More data for this
Ligand-Target Pair
Galectin-1


(Homo sapiens (human))
BDBM50244378
PNG
((2R,3S,4S,5S,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6...)
Show SMILES CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OC(=O)c2ccc(C)cc2)[C@@H]1O
Show InChI InChI=1S/C15H20O7/c1-8-3-5-9(6-4-8)14(19)22-13-11(17)10(7-16)21-15(20-2)12(13)18/h3-6,10-13,15-18H,7H2,1-2H3/t10-,11+,12+,13+,15-/m1/s1
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n/an/an/a 2.00E+6n/an/an/an/an/a



Lund University

Curated by ChEMBL


Assay Description
Binding affinity to human galectin1 by fluorescence polarization assay


Bioorg Med Chem Lett 18: 3691-4 (2008)

More data for this
Ligand-Target Pair
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