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BDBM50316186 4-(2-(4-amino-1,2,5-oxadiazol-3-yl)-6-(aminomethyl)-1-ethyl-1H-imidazo[4,5-c]pyridin-4-yl)-2-methylbut-3-yn-2-ol::CHEMBL1098241

SMILES: CCn1c(nc2c(nc(CN)cc12)C#CC(C)(C)O)-c1nonc1N

InChI Key: InChIKey=SAJJWJQNKYDEPD-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50316186   
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
Serine/threonine-protein kinase AKT


(Homo sapiens (Human))
BDBM50316186
PNG
(4-(2-(4-amino-1,2,5-oxadiazol-3-yl)-6-(aminomethyl...)
Show SMILES CCn1c(nc2c(nc(CN)cc12)C#CC(C)(C)O)-c1nonc1N
Show InChI InChI=1S/C16H19N7O2/c1-4-23-11-7-9(8-17)19-10(5-6-16(2,3)24)12(11)20-15(23)13-14(18)22-25-21-13/h7,24H,4,8,17H2,1-3H3,(H2,18,22)
PDB
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PC cid
PC sid
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Article
PubMed
n/an/a 70n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of AKT3


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))
BDBM50316186
PNG
(4-(2-(4-amino-1,2,5-oxadiazol-3-yl)-6-(aminomethyl...)
Show SMILES CCn1c(nc2c(nc(CN)cc12)C#CC(C)(C)O)-c1nonc1N
Show InChI InChI=1S/C16H19N7O2/c1-4-23-11-7-9(8-17)19-10(5-6-16(2,3)24)12(11)20-15(23)13-14(18)22-25-21-13/h7,24H,4,8,17H2,1-3H3,(H2,18,22)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6n/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
Serine/threonine-protein kinase AKT2


(Homo sapiens (Human))
BDBM50316186
PNG
(4-(2-(4-amino-1,2,5-oxadiazol-3-yl)-6-(aminomethyl...)
Show SMILES CCn1c(nc2c(nc(CN)cc12)C#CC(C)(C)O)-c1nonc1N
Show InChI InChI=1S/C16H19N7O2/c1-4-23-11-7-9(8-17)19-10(5-6-16(2,3)24)12(11)20-15(23)13-14(18)22-25-21-13/h7,24H,4,8,17H2,1-3H3,(H2,18,22)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 63n/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
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50316186
PNG
(4-(2-(4-amino-1,2,5-oxadiazol-3-yl)-6-(aminomethyl...)
Show SMILES CCn1c(nc2c(nc(CN)cc12)C#CC(C)(C)O)-c1nonc1N
Show InChI InChI=1S/C16H19N7O2/c1-4-23-11-7-9(8-17)19-10(5-6-16(2,3)24)12(11)20-15(23)13-14(18)22-25-21-13/h7,24H,4,8,17H2,1-3H3,(H2,18,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

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UniProtKB/TrEMBL

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PC sid
UniChem

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Article
PubMed
n/an/a 1.02E+3n/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