BDBM50338139 ((1S,4S)-5-benzoyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)((1S,3R)-3-(3-fluorotetrahydro-2H-pyran-4-ylamino)-1-isopropylcyclopentyl)methanone::CHEMBL1684710

SMILES: CC(C)[C@@]1(CC[C@H](C1)NC1CCOCC1F)C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccccc1

InChI Key: InChIKey=KLTDSWXNEIJHCK-BDLGRFBASA-N

Data: 1 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 1 hit for monomerid = 50338139   

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))	BDBM50338139 (((1S,4S)-5-benzoyl-2,5-diazabicyclo[2.2.1]heptan-2...) Show SMILES CC(C)[C@@]1(CC[C@H](C1)NC1CCOCC1F)C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccccc1 |r| Show InChI InChI=1S/C26H36FN3O3/c1-17(2)26(10-8-19(13-26)28-23-9-11-33-16-22(23)27)25(32)30-15-20-12-21(30)14-29(20)24(31)18-6-4-3-5-7-18/h3-7,17,19-23,28H,8-16H2,1-2H3/t19-,20+,21+,22?,23?,26+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	17.5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [125I]MCP1 from human CCR2 preincubated 30 mins by human whole cell binding assay				Bioorg Med Chem Lett 21: 1827-31 (2011) Article DOI: 10.1016/j.bmcl.2011.01.052 BindingDB Entry DOI: 10.7270/Q2GM87M5
					More data for this Ligand-Target Pair