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BDBM50170432 CHEMBL3805691

SMILES: Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)NC1(CCNCC1)c1ccc(F)cc1

InChI Key: InChIKey=MEMRHVNWMQWCLF-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50170432   
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
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50170432
PNG
(CHEMBL3805691)
Show SMILES Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)NC1(CCNCC1)c1ccc(F)cc1 |(.16,9.88,;-1.04,9.6,;-2.21,10.59,;-3.53,9.79,;-3.16,8.29,;-3.96,7.35,;-1.64,8.19,;-.74,6.95,;-1.21,5.48,;.04,4.6,;1.28,5.49,;.8,6.95,;1.53,7.95,;.04,3.06,;1.1,2.44,;-1.3,2.29,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;-2.63,-.02,;-2.59,-1.56,;-3.91,-2.36,;-5.26,-1.63,;-6.31,-2.27,;-5.3,-.09,;-3.98,.71,)|
Show InChI InChI=1S/C20H19Cl2FN4O2/c1-27-17(15(21)11-25-27)14-10-16(29-18(14)22)19(28)26-20(6-8-24-9-7-20)12-2-4-13(23)5-3-12/h2-5,10-11,24H,6-9H2,1H3,(H,26,28)
PDB

UniProtKB/SwissProt

antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 390n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) expressed in Escherichia coli using peptide substrate after 1 hr by HTRF assay

Eur J Med Chem 117: 47-58 (2016)


BindingDB Entry DOI: 10.7270/Q2QJ7K5K
More data for this
Ligand-Target Pair