BindingDB logo
myBDB logout

null

SMILES: CCN(CC)CCOc1ccc2C(=O)c3c([nH]c4cc(Br)ccc34)C(C)(C)c2c1

InChI Key: InChIKey=HRRHNBAOOLQDSJ-UHFFFAOYSA-N

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 = 50344651   
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
ALK tyrosine kinase receptor


(Homo sapiens (Human))		BDBM50344651
PNG
(3-bromo-8-(2-(diethylamino)ethoxy)-6,6-dimethyl-5H...)
Show SMILES CCN(CC)CCOc1ccc2C(=O)c3c([nH]c4cc(Br)ccc34)C(C)(C)c2c1
Show InChI InChI=1S/C24H27BrN2O2/c1-5-27(6-2)11-12-29-16-8-10-17-19(14-16)24(3,4)23-21(22(17)28)18-9-7-15(25)13-20(18)26-23/h7-10,13-14,26H,5-6,11-12H2,1-4H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Chugai Pharmaceutical Co. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of ALK assessed as biotin-EGPWLEEEEEAYGWMDF peptide phosphorylation by TR-FRET assay

Bioorg Med Chem Lett 21: 3788-93 (2011)

Checked by Author
Article DOI: 10.1016/j.bmcl.2011.04.020
BindingDB Entry DOI: 10.7270/Q2Q81DF2
More data for this
Ligand-Target Pair