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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'L-selectin' and Ligand = 'BDBM50072622'   
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
L-selectin


(Homo sapiens (Human))		BDBM50072622
PNG
(CHEMBL113316 | [3,4,5-Trimethoxy-2-(3,4,5-trihydro...)
Show SMILES COc1cc(CC(O)=O)c(C2OC(C)C(O)C(O)C2O)c(OC)c1OC
Show InChI InChI=1S/C17H24O9/c1-7-12(20)13(21)14(22)16(26-7)11-8(6-10(18)19)5-9(23-2)15(24-3)17(11)25-4/h5,7,12-14,16,20-22H,6H2,1-4H3,(H,18,19)
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n/an/a 1.14E+5n/an/an/an/an/an/a



Sankyo Co. Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against L-selectin IgG chimeras binding to sLex coating 96 wells using competitive cell-free ELISA assay was dete...

Bioorg Med Chem Lett 8: 3307-10 (1999)


BindingDB Entry DOI: 10.7270/Q2W0953H
More data for this
Ligand-Target Pair