BindingDB logo
myBDB logout

BDBM50222234 (E)-3-(4-fluorophenyl)-N-(4-(4-(4-methoxyphenyl)piperidin-1-yl)butyl)acrylamide::CHEMBL248638

SMILES: COc1ccc(cc1)C1CCN(CCCCNC(=O)\C=C\c2ccc(F)cc2)CC1

InChI Key: InChIKey=FZFOOQCAPGGAEV-AWNIVKPZSA-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 = 50222234   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50222234
PNG
((E)-3-(4-fluorophenyl)-N-(4-(4-(4-methoxyphenyl)pi...)
Show SMILES COc1ccc(cc1)C1CCN(CCCCNC(=O)\C=C\c2ccc(F)cc2)CC1
Show InChI InChI=1S/C25H31FN2O2/c1-30-24-11-7-21(8-12-24)22-14-18-28(19-15-22)17-3-2-16-27-25(29)13-6-20-4-9-23(26)10-5-20/h4-13,22H,2-3,14-19H2,1H3,(H,27,29)/b13-6+
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.30E+3n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development LLC

Curated by ChEMBL


Assay Description
Displacement of [125]MCP1 from human CCR2 receptor in THP1 cells


Bioorg Med Chem Lett 17: 5964-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.065
BindingDB Entry DOI: 10.7270/Q2WD408X
More data for this
Ligand-Target Pair