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 = 'BDBM50248545'   

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))	BDBM50248545 ((S)-3-(2-(1-(benzo[d][1,3]dioxol-5-yl)-2,2,2-trifl...) Show SMILES CN(C)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc4OCOc4c3)C(F)(F)F)c(=O)c2=O)c1O |r| Show InChI InChI=1S/C22H18F3N3O6/c1-28(2)21(32)11-4-3-5-12(17(11)29)26-15-16(19(31)18(15)30)27-20(22(23,24)25)10-6-7-13-14(8-10)34-9-33-13/h3-8,20,26-27,29H,9H2,1-2H3/t20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Binding affinity to CXCR2 (unknown origin)				Bioorg Med Chem Lett 19: 1431-3 (2009) Article DOI: 10.1016/j.bmcl.2009.01.033 BindingDB Entry DOI: 10.7270/Q2CV4HMF
					More data for this Ligand-Target Pair