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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'RAC-alpha serine/threonine-protein kinase' and Ligand = 'BDBM50243763'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM50243763
PNG
(6-phenyl-2-(piperidin-1-yl)-7-(4-((4-(5-(pyridin-2...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCCCC1
Show InChI InChI=1S/C37H37N9/c1-3-9-27(10-4-1)31-23-30-24-39-37(46-19-7-2-8-20-46)42-34(30)40-33(31)28-14-12-26(13-15-28)25-45-21-16-29(17-22-45)35-41-36(44-43-35)32-11-5-6-18-38-32/h1,3-6,9-15,18,23-24,29H,2,7-8,16-17,19-22,25H2,(H,41,43,44)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 18n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.085
BindingDB Entry DOI: 10.7270/Q2F76CBC
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50243763
PNG
(6-phenyl-2-(piperidin-1-yl)-7-(4-((4-(5-(pyridin-2...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCCCC1
Show InChI InChI=1S/C37H37N9/c1-3-9-27(10-4-1)31-23-30-24-39-37(46-19-7-2-8-20-46)42-34(30)40-33(31)28-14-12-26(13-15-28)25-45-21-16-29(17-22-45)35-41-36(44-43-35)32-11-5-6-18-38-32/h1,3-6,9-15,18,23-24,29H,2,7-8,16-17,19-22,25H2,(H,41,43,44)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 36n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.085
BindingDB Entry DOI: 10.7270/Q2F76CBC
More data for this
Ligand-Target Pair