Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-X-C chemokine receptor type 2' and Ligand = 'BDBM50193982'   

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
C-X-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50193982 (3-(2-bromophenyl)-2-cyano-1-(2-hydroxy-3-{[3-(morp...) Show SMILES CCC(CC)(NS(=O)(=O)c1cccc(N=C(NC#N)Nc2ccccc2Br)c1O)N1CCOCC1 |w:14.13| Show InChI InChI=1S/C23H29BrN6O4S/c1-3-23(4-2,30-12-14-34-15-13-30)29-35(32,33)20-11-7-10-19(21(20)31)28-22(26-16-25)27-18-9-6-5-8-17(18)24/h5-11,29,31H,3-4,12-15H2,1-2H3,(H2,26,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Displacement of [125I]IL8 from CXCR2 expressed in CHO cells				Bioorg Med Chem Lett 16: 5513-6 (2006) Article DOI: 10.1016/j.bmcl.2006.08.042 BindingDB Entry DOI: 10.7270/Q2NV9HWD
					More data for this Ligand-Target Pair