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SMILES: OC(=O)c1ccc(cc1)-c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1

InChI Key: InChIKey=QUPGYHDGQKKHHR-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50201950   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
P-selectin glycoprotein ligand 1


(Homo sapiens (Human))		BDBM50201950
PNG
(8-(4-carboxyphenyl)-2-(4-chlorophenyl)-3-hydroxyqu...)
Show SMILES OC(=O)c1ccc(cc1)-c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H14ClNO5/c24-15-10-8-13(9-11-15)19-21(26)18(23(29)30)17-3-1-2-16(20(17)25-19)12-4-6-14(7-5-12)22(27)28/h1-11,26H,(H,27,28)(H,29,30)
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Article
PubMed
n/an/a 1.50E+6n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of P-selectin-mediated adhesion of HL60 cells

J Med Chem 50: 21-39 (2007)


Article DOI: 10.1021/jm0602256
BindingDB Entry DOI: 10.7270/Q2Z60PVV
More data for this
Ligand-Target Pair