Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetC-C chemokine receptor type 4
LigandBDBM50307050
Substrate/Competitorn/a
Meas. Tech.ChEMBL_609338 (CHEMBL1072093)
IC50 3120±n/a nM
Citation Li, GWang, DSun, MLi, GHu, JZhang, YYuan, YJi, HChen, NLiu, G Discovery and optimization of novel 3-piperazinylcoumarin antagonist of chemokine-like factor 1 with oral antiasthma activity in mice. J Med Chem53:1741-54 (2010) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
C-C chemokine receptor type 4
Name:C-C chemokine receptor type 4
Synonyms:C-C CKR-4 | C-C chemokine receptor type 4 | C-C chemokine receptor type 4 (CCR4) | CC-CKR-4 | CCR-4 | CCR4 | CCR4_HUMAN | CD_antigen=CD194 | CMKBR4 | K5-5
Type:Enzyme
Mol. Mass.:41406.41
Organism:Homo sapiens (Human)
Description:P51679
Residue:360
Sequence:
MNPTDIADTTLDESIYSNYYLYESIPKPCTKEGIKAFGELFLPPLYSLVFVFGLLGNSVV
VLVLFKYKRLRSMTDVYLLNLAISDLLFVFSLPFWGYYAADQWVFGLGLCKMISWMYLVG
FYSGIFFVMLMSIDRYLAIVHAVFSLRARTLTYGVITSLATWSVAVFASLPGFLFSTCYT
ERNHTYCKTKYSLNSTTWKVLSSLEINILGLVIPLGIMLFCYSMIIRTLQHCKNEKKNKA
VKMIFAVVVLFLGFWTPYNIVLFLETLVELEVLQDCTFERYLDYAIQATETLAFVHCCLN
PIIYFFLGEKFRKYILQLFKTCRGLFVLCQYCGLLQIYSADTPSSSYTQSTMDHDLHDAL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50307050
n/a
NameBDBM50307050
Synonyms:7-(4-Ethylcyclohexyloxy)-4-methyl-3-(4-methylpiperazin-1-yl)-2H-chromen-2-one | CHEMBL611508
TypeSmall organic molecule
Emp. Form.C23H32N2O3
Mol. Mass.384.5118
SMILESCCC1CCC(CC1)Oc1ccc2c(C)c(N3CCN(C)CC3)c(=O)oc2c1 |(-9.45,3.17,;-9.45,1.63,;-8.12,.86,;-6.78,1.62,;-5.45,.85,;-5.45,-.7,;-6.79,-1.47,;-8.13,-.69,;-4.11,-1.46,;-2.78,-.69,;-2.78,.85,;-1.44,1.62,;-.12,.85,;1.22,1.62,;1.22,3.16,;2.55,.85,;3.89,1.63,;5.21,.85,;6.54,1.62,;6.55,3.16,;7.88,3.93,;5.21,3.93,;3.87,3.16,;2.56,-.69,;3.9,-1.47,;1.22,-1.46,;-.12,-.68,;-1.44,-1.46,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: