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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Galectin-9' and Ligand = 'BDBM50273430'   
Target/Host
(Institution)		LigandTarget/Host
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-9


(Homo sapiens (Human))		BDBM50273430
PNG
(Bis-(3-O-benzoyl-beta-D-galactopyranosyl)sulfane |...)
Show SMILES OC[C@H]1O[C@@H](S[C@@H]2O[C@H](CO)[C@H](O)[C@H](OC(=O)c3ccccc3)[C@H]2O)[C@H](O)[C@@H](OC(=O)c2ccccc2)[C@H]1O |r|
Show InChI InChI=1S/C26H30O12S/c27-11-15-17(29)21(37-23(33)13-7-3-1-4-8-13)19(31)25(35-15)39-26-20(32)22(18(30)16(12-28)36-26)38-24(34)14-9-5-2-6-10-14/h1-10,15-22,25-32H,11-12H2/t15-,16-,17+,18+,19-,20-,21+,22+,25+,26+/m1/s1
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KEGG

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PC cid
PC sid
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Similars
Article
PubMed
n/an/an/a 2.20E+3n/an/an/an/an/a



Lund University

Curated by ChEMBL


Assay Description
Binding affinity to galectin 9N terminal domain at 0 degC by fluorescence polarization assay

J Med Chem 51: 8109-14 (2008)


Article DOI: 10.1021/jm801077j
BindingDB Entry DOI: 10.7270/Q29W0GDJ
More data for this
Ligand-Target Pair