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BDBM50316199 4-(2-(4-amino-1,2,5-oxadiazol-3-yl)-6-((R)-2-aminopropoxy)-1-ethyl-1H-imidazo[4,5-c]pyridin-4-yl)-2-methylbut-3-yn-2-ol::CHEMBL1098944

SMILES: CCn1c(nc2c(nc(OC[C@@H](C)N)cc12)C#CC(C)(C)O)-c1nonc1N

InChI Key: InChIKey=CGJRAACGTIIYDY-SNVBAGLBSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50316199   
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
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50316199
PNG
(4-(2-(4-amino-1,2,5-oxadiazol-3-yl)-6-((R)-2-amino...)
Show SMILES CCn1c(nc2c(nc(OC[C@@H](C)N)cc12)C#CC(C)(C)O)-c1nonc1N |r|
Show InChI InChI=1S/C18H23N7O3/c1-5-25-12-8-13(27-9-10(2)19)21-11(6-7-18(3,4)26)14(12)22-17(25)15-16(20)24-28-23-15/h8,10,26H,5,9,19H2,1-4H3,(H2,20,24)/t10-/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 400n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of GSK3beta phosphorylation in human BT474 cells


Bioorg Med Chem Lett 19: 1508-11 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.002
BindingDB Entry DOI: 10.7270/Q2XK8FP7
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT2


(Homo sapiens (Human))
BDBM50316199
PNG
(4-(2-(4-amino-1,2,5-oxadiazol-3-yl)-6-((R)-2-amino...)
Show SMILES CCn1c(nc2c(nc(OC[C@@H](C)N)cc12)C#CC(C)(C)O)-c1nonc1N |r|
Show InChI InChI=1S/C18H23N7O3/c1-5-25-12-8-13(27-9-10(2)19)21-11(6-7-18(3,4)26)14(12)22-17(25)15-16(20)24-28-23-15/h8,10,26H,5,9,19H2,1-4H3,(H2,20,24)/t10-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 50n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of AKT2


Bioorg Med Chem Lett 19: 1508-11 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.002
BindingDB Entry DOI: 10.7270/Q2XK8FP7
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50316199
PNG
(4-(2-(4-amino-1,2,5-oxadiazol-3-yl)-6-((R)-2-amino...)
Show SMILES CCn1c(nc2c(nc(OC[C@@H](C)N)cc12)C#CC(C)(C)O)-c1nonc1N |r|
Show InChI InChI=1S/C18H23N7O3/c1-5-25-12-8-13(27-9-10(2)19)21-11(6-7-18(3,4)26)14(12)22-17(25)15-16(20)24-28-23-15/h8,10,26H,5,9,19H2,1-4H3,(H2,20,24)/t10-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of AKT


Bioorg Med Chem Lett 19: 1508-11 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.002
BindingDB Entry DOI: 10.7270/Q2XK8FP7
More data for this
Ligand-Target Pair