BDBM50359105 CHEMBL1922811

SMILES: NC(=O)C(NC1CCC(CC1)c1c[nH]c2ccccc12)C1CCN(CC1)C(=O)Nc1ccccc1

InChI Key: InChIKey=HYYKYUXOHZXPGO-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50359105   

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-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50359105 (CHEMBL1922811) Show SMILES NC(=O)C(NC1CCC(CC1)c1c[nH]c2ccccc12)C1CCN(CC1)C(=O)Nc1ccccc1 |(-7.99,-9.65,;-6.66,-10.43,;-5.32,-9.66,;-6.66,-11.97,;-8,-12.73,;-8,-14.27,;-9.34,-15.03,;-9.34,-16.57,;-8.01,-17.34,;-6.67,-16.58,;-6.67,-15.03,;-8.02,-18.88,;-9.26,-19.79,;-8.78,-21.26,;-7.24,-21.25,;-6.22,-22.39,;-4.71,-22.07,;-4.24,-20.6,;-5.27,-19.46,;-6.77,-19.79,;-5.33,-12.74,;-5.34,-14.28,;-4.02,-15.06,;-2.68,-14.3,;-2.67,-12.75,;-4,-11.97,;-1.35,-15.07,;-1.36,-16.61,;-.01,-14.31,;1.32,-15.09,;1.3,-16.63,;2.63,-17.41,;3.97,-16.65,;3.97,-15.1,;2.64,-14.33,)| Show InChI InChI=1S/C28H35N5O2/c29-27(34)26(20-14-16-33(17-15-20)28(35)32-21-6-2-1-3-7-21)31-22-12-10-19(11-13-22)24-18-30-25-9-5-4-8-23(24)25/h1-9,18-20,22,26,30-31H,10-17H2,(H2,29,34)(H,32,35)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.57E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Antagonist activity at human CCR2				Bioorg Med Chem Lett 21: 7496-501 (2011) Article DOI: 10.1016/j.bmcl.2011.09.113 BindingDB Entry DOI: 10.7270/Q22J6C9M
					More data for this Ligand-Target Pair