Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'C-X-C chemokine receptor type 2' and Ligand = 'BDBM50115222'   

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))	BDBM50115222 (CHEMBL3609000 | USRE47740, Compound 10 | USRE48547...) Show SMILES OB(O)c1ccccc1CNc1ccc(cn1)C(=O)Nc1ccc(F)cc1 Show InChI InChI=1S/C19H17BFN3O3/c21-15-6-8-16(9-7-15)24-19(25)14-5-10-18(23-12-14)22-11-13-3-1-2-4-17(13)20(26)27/h1-10,12,26-27H,11H2,(H,22,23)(H,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntrix Biosystems Inc. US Patent					Assay Description Briefly, human neutrophils were suspended in HBSS− (without Ca2+ and Mg2+) containing 10 mM HEPES and FLIPR Calcium 3 dye (3.1×107 cells in tot...				US Patent USRE47740 (2019) BindingDB Entry DOI: 10.7270/Q21G0PM3
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50115222 (CHEMBL3609000 | USRE47740, Compound 10 | USRE48547...) Show SMILES OB(O)c1ccccc1CNc1ccc(cn1)C(=O)Nc1ccc(F)cc1 Show InChI InChI=1S/C19H17BFN3O3/c21-15-6-8-16(9-7-15)24-19(25)14-5-10-18(23-12-14)22-11-13-3-1-2-4-17(13)20(26)27/h1-10,12,26-27H,11H2,(H,22,23)(H,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntrix Biosystems Inc. US Patent					Assay Description An in vitro assay showed inhibition of CXCR2-mediated intracellular calcium release by treatment with compound 9 (IC50=586±91 nM). Briefly, human neu...				US Patent USRE48547 (2021) BindingDB Entry DOI: 10.7270/Q2SB48V7
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50115222 (CHEMBL3609000 | USRE47740, Compound 10 | USRE48547...) Show SMILES OB(O)c1ccccc1CNc1ccc(cn1)C(=O)Nc1ccc(F)cc1 Show InChI InChI=1S/C19H17BFN3O3/c21-15-6-8-16(9-7-15)24-19(25)14-5-10-18(23-12-14)22-11-13-3-1-2-4-17(13)20(26)27/h1-10,12,26-27H,11H2,(H,22,23)(H,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntrix Biosystems Curated by ChEMBL					Assay Description Antagonist activity at CXCR2 (unknown origin) transfected in RBL cells assessed as inhibition of IL-8-mediated intracellular calcium release preincub...				Bioorg Med Chem Lett 25: 3793-7 (2015) Article DOI: 10.1016/j.bmcl.2015.07.090 BindingDB Entry DOI: 10.7270/Q2V989VF
					More data for this Ligand-Target Pair