Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor-like 2' and Ligand = 'BDBM50425705'   

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-C chemokine receptor-like 2 (Homo sapiens (Human))	BDBM50425705 (CHEMBL2315922 | US9062048, 83) Show SMILES O[C@]1(CC[C@@H](CC1)N1CC(C1)NC(=O)CNc1ncnc2ccc(cc12)C(F)(F)F)c1nccs1 |r,wU:4.7,wD:1.0,(52.5,-3.46,;53.29,-4.8,;54.1,-6.11,;55.64,-6.07,;56.36,-4.71,;55.55,-3.4,;54.02,-3.45,;57.9,-4.66,;58.95,-3.53,;60.08,-4.58,;59.03,-5.71,;61.62,-4.53,;62.43,-5.84,;61.71,-7.19,;63.97,-5.79,;64.78,-7.09,;66.32,-7.04,;67.14,-8.35,;68.69,-8.3,;69.41,-6.94,;68.59,-5.63,;69.31,-4.27,;68.5,-2.97,;66.96,-3.02,;66.23,-4.38,;67.05,-5.68,;66.15,-1.71,;66.88,-.36,;64.61,-1.76,;65.37,-.37,;51.75,-4.85,;50.88,-6.14,;49.4,-5.71,;49.35,-4.17,;50.8,-3.64,)| Show InChI InChI=1S/C23H25F3N6O2S/c24-23(25,26)14-1-2-18-17(9-14)20(30-13-29-18)28-10-19(33)31-15-11-32(12-15)16-3-5-22(34,6-4-16)21-27-7-8-35-21/h1-2,7-9,13,15-16,34H,3-6,10-12H2,(H,31,33)(H,28,29,30)/t16-,22-	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description Human monocytic cell line THP-1 cells were obtained from American Type Culture Collection (Manassas, Va., USA). The THP-1 cells were grown in RPMI-16...				US Patent US9062048 (2015) BindingDB Entry DOI: 10.7270/Q2ZP44W1
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