BDBM50131188 5-(2,4-Dichloro-phenyl)-2-(3-phenoxy-benzyl)-2H-[1,2,4]triazole-3-thiol::CHEMBL315588

SMILES: Clc1ccc(-c2nn(Cc3cccc(Oc4ccccc4)c3)c(=S)[nH]2)c(Cl)c1

InChI Key: InChIKey=VGWBEDMOOQUIKD-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50131188   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
C-X-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50131188 (5-(2,4-Dichloro-phenyl)-2-(3-phenoxy-benzyl)-2H-[1...) Show SMILES Clc1ccc(-c2nn(Cc3cccc(Oc4ccccc4)c3)c(=S)[nH]2)c(Cl)c1 Show InChI InChI=1S/C21H15Cl2N3OS/c22-15-9-10-18(19(23)12-15)20-24-21(28)26(25-20)13-14-5-4-8-17(11-14)27-16-6-2-1-3-7-16/h1-12H,13H2,(H,24,25,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Charnwood Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-IL8 to human recombinant CXC chemokine receptor 2 (CXCR2) expressed in HEK 293 membranes				Bioorg Med Chem Lett 13: 2625-8 (2003) BindingDB Entry DOI: 10.7270/Q2B56J5K
					More data for this Ligand-Target Pair