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SMILES: OC(=O)c1c(O)c(nc2c(cccc12)-c1ccsc1)-c1ccc(Cl)cc1

InChI Key: InChIKey=PDKJNYNFZNJWAN-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50201947   
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))		BDBM50201947
PNG
(2-(4-chlorophenyl)-3-hydroxy-8-(thien-3-yl)quinoli...)
Show SMILES OC(=O)c1c(O)c(nc2c(cccc12)-c1ccsc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C20H12ClNO3S/c21-13-6-4-11(5-7-13)17-19(23)16(20(24)25)15-3-1-2-14(18(15)22-17)12-8-9-26-10-12/h1-10,23H,(H,24,25)
NCI pathway
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KEGG

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Similars
Article
PubMed
n/an/a 1.75E+5n/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