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BDBM50084452 CHEMBL3426868

SMILES: Clc1cnc(Nc2ccc(cc2)N2CCNCC2)nc1NCC1CCCO1

InChI Key: InChIKey=QEIBQCGEIITGSB-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50084452   
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
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM50084452
PNG
(CHEMBL3426868)
Show SMILES Clc1cnc(Nc2ccc(cc2)N2CCNCC2)nc1NCC1CCCO1
Show InChI InChI=1/C19H25ClN6O/c20-17-13-23-19(25-18(17)22-12-16-2-1-11-27-16)24-14-3-5-15(6-4-14)26-9-7-21-8-10-26/h3-6,13,16,21H,1-2,7-12H2,(H2,22,23,24,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 81n/an/an/an/an/an/a



University of South Florida

Curated by ChEMBL


Assay Description
Inhibition of human ACK1 using EAIYAAPFAKKK peptide substrate by 33P Hotspot assay


J Med Chem 58: 2746-63 (2015)


Article DOI: 10.1021/jm501929n
BindingDB Entry DOI: 10.7270/Q2H996XC
More data for this
Ligand-Target Pair