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BDBM50528421 CHEMBL4451765

SMILES: Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCCO)C[C@H]1c1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=JCGYWMXZWKOZBK-BIENJYKASA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50528421   
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))		BDBM50528421
PNG
(CHEMBL4451765)
Show SMILES Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCCO)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:25.28,(51.63,-7.29,;51.3,-8.79,;49.9,-9.41,;50.05,-10.95,;51.56,-11.27,;52.18,-12.68,;52.33,-9.94,;53.87,-9.78,;54.89,-10.93,;56.31,-10.3,;56.15,-8.77,;54.64,-8.45,;54.02,-7.04,;57.64,-11.08,;57.64,-12.62,;58.98,-10.31,;60.31,-11.08,;60.3,-12.62,;61.63,-13.39,;62.97,-12.63,;64.3,-13.4,;65.64,-12.64,;66.97,-13.41,;68.31,-12.65,;62.98,-11.08,;61.65,-10.32,;61.64,-8.79,;60.31,-8.02,;60.31,-6.47,;61.64,-5.7,;61.64,-4.16,;62.98,-6.46,;64.31,-5.69,;62.98,-8.01,)|
Show InChI InChI=1S/C23H24Cl4N4O3/c1-31-21(18(26)10-29-31)15-9-20(34-22(15)27)23(33)30-19-11-28-13(3-2-6-32)8-14(19)12-4-5-16(24)17(25)7-12/h4-5,7,9-10,13-14,19,28,32H,2-3,6,8,11H2,1H3,(H,30,33)/t13-,14+,19-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.60n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human Akt1 expressed in Escherichia coli using STK Substrate 2-biotin as substrate incubated for 1 hr by HTRF assay

J Med Chem 62: 7264-7288 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00891
More data for this
Ligand-Target Pair