Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Polyunsaturated fatty acid 5-lipoxygenase' and Ligand = 'BDBM50085183'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50085183 (2-{2-Phenyl-1-[4-(quinolin-2-ylmethoxy)-phenyl]-et...) Show SMILES C\C(=N/OC(Cc1ccccc1)c1ccc(OCc2ccc3ccccc3n2)cc1)C(O)=O Show InChI InChI=1S/C27H24N2O4/c1-19(27(30)31)29-33-26(17-20-7-3-2-4-8-20)22-12-15-24(16-13-22)32-18-23-14-11-21-9-5-6-10-25(21)28-23/h2-16,26H,17-18H2,1H3,(H,30,31)/b29-19+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of calcium ionophore (A-23187)-stimulated LTB4 formation in human neutrophil assay				J Med Chem 43: 690-705 (2000) BindingDB Entry DOI: 10.7270/Q2HD7WCR
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