BDBM50381180 CHEMBL2018389

SMILES: CCC[C@H](O)[C@H](CNCc1ccc(C)cc1C)NC(=O)CNC(=O)c1cc(ccc1NC(=O)N1CCCC1)C(F)(F)F

InChI Key: InChIKey=NYAVJXWOIUBMDR-UIOOFZCWSA-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 = 50381180   

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))	BDBM50381180 (CHEMBL2018389) Show SMILES CCC[C@H](O)[C@H](CNCc1ccc(C)cc1C)NC(=O)CNC(=O)c1cc(ccc1NC(=O)N1CCCC1)C(F)(F)F |r| Show InChI InChI=1S/C30H40F3N5O4/c1-4-7-26(39)25(17-34-16-21-9-8-19(2)14-20(21)3)36-27(40)18-35-28(41)23-15-22(30(31,32)33)10-11-24(23)37-29(42)38-12-5-6-13-38/h8-11,14-15,25-26,34,39H,4-7,12-13,16-18H2,1-3H3,(H,35,41)(H,36,40)(H,37,42)/t25-,26-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80	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))	BDBM50381180 (CHEMBL2018389) Show SMILES CCC[C@H](O)[C@H](CNCc1ccc(C)cc1C)NC(=O)CNC(=O)c1cc(ccc1NC(=O)N1CCCC1)C(F)(F)F |r| Show InChI InChI=1S/C30H40F3N5O4/c1-4-7-26(39)25(17-34-16-21-9-8-19(2)14-20(21)3)36-27(40)18-35-28(41)23-15-22(30(31,32)33)10-11-24(23)37-29(42)38-12-5-6-13-38/h8-11,14-15,25-26,34,39H,4-7,12-13,16-18H2,1-3H3,(H,35,41)(H,36,40)(H,37,42)/t25-,26-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20	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