BDBM50381187 CHEMBL2018397

SMILES: CCC[C@H](O)[C@H](CNCc1ccc(C)cc1C)NC(=O)CC(=O)Nc1cccc(c1)C(F)(F)F

InChI Key: InChIKey=CEIILCAEYUCRNV-VXKWHMMOSA-N

Data: 2 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 2 hits for monomerid = 50381187   

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))	BDBM50381187 (CHEMBL2018397) Show SMILES CCC[C@H](O)[C@H](CNCc1ccc(C)cc1C)NC(=O)CC(=O)Nc1cccc(c1)C(F)(F)F |r| Show InChI InChI=1S/C25H32F3N3O3/c1-4-6-22(32)21(15-29-14-18-10-9-16(2)11-17(18)3)31-24(34)13-23(33)30-20-8-5-7-19(12-20)25(26,27)28/h5,7-12,21-22,29,32H,4,6,13-15H2,1-3H3,(H,30,33)(H,31,34)/t21-,22-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Displacement of [125-I]MCP1 from CCR2 on human PBMC				Bioorg Med Chem Lett 22: 3311-6 (2012) Article DOI: 10.1016/j.bmcl.2012.03.007 BindingDB Entry DOI: 10.7270/Q2PN96MB
					More data for this Ligand-Target Pair
C-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50381187 (CHEMBL2018397) Show SMILES CCC[C@H](O)[C@H](CNCc1ccc(C)cc1C)NC(=O)CC(=O)Nc1cccc(c1)C(F)(F)F |r| Show InChI InChI=1S/C25H32F3N3O3/c1-4-6-22(32)21(15-29-14-18-10-9-16(2)11-17(18)3)31-24(34)13-23(33)30-20-8-5-7-19(12-20)25(26,27)28/h5,7-12,21-22,29,32H,4,6,13-15H2,1-3H3,(H,30,33)(H,31,34)/t21-,22-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Antagonist activity at CCR2 in human PBMC assessed as inhibition of MCP1-induced chemotaxis				Bioorg Med Chem Lett 22: 3311-6 (2012) Article DOI: 10.1016/j.bmcl.2012.03.007 BindingDB Entry DOI: 10.7270/Q2PN96MB
					More data for this Ligand-Target Pair