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SMILES: c1ccc(nc1)C#Cc1n[nH]c2ccccc12

InChI Key: InChIKey=PDHRIFYPBBUERI-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50333025   
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 mTOR


(Homo sapiens (Human))
BDBM50333025
PNG
(3-(Pyridin-2-ylethynyl)-1H-indazole | CHEMBL163189...)
Show SMILES c1ccc(nc1)C#Cc1n[nH]c2ccccc12
Show InChI InChI=1S/C14H9N3/c1-2-7-13-12(6-1)14(17-16-13)9-8-11-5-3-4-10-15-11/h1-7,10H,(H,16,17)
PDB
MMDB

NCI pathway
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KEGG

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n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of mTORC1 expressed in HEK293 cells assessed as PRAS40 Ser183 phosphorylation level by LanthaScreen cellular assay


J Med Chem 53: 8368-8375 (2010)


Article DOI: 10.1021/jm100825h
BindingDB Entry DOI: 10.7270/Q2NP24PS
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50333025
PNG
(3-(Pyridin-2-ylethynyl)-1H-indazole | CHEMBL163189...)
Show SMILES c1ccc(nc1)C#Cc1n[nH]c2ccccc12
Show InChI InChI=1S/C14H9N3/c1-2-7-13-12(6-1)14(17-16-13)9-8-11-5-3-4-10-15-11/h1-7,10H,(H,16,17)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha by LanthaScreen Eu kinase binding assay


J Med Chem 53: 8368-8375 (2010)


Article DOI: 10.1021/jm100825h
BindingDB Entry DOI: 10.7270/Q2NP24PS
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (Human))
BDBM50333025
PNG
(3-(Pyridin-2-ylethynyl)-1H-indazole | CHEMBL163189...)
Show SMILES c1ccc(nc1)C#Cc1n[nH]c2ccccc12
Show InChI InChI=1S/C14H9N3/c1-2-7-13-12(6-1)14(17-16-13)9-8-11-5-3-4-10-15-11/h1-7,10H,(H,16,17)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of mTOR by LanthaScreen Eu kinase binding assay


J Med Chem 53: 8368-8375 (2010)


Article DOI: 10.1021/jm100825h
BindingDB Entry DOI: 10.7270/Q2NP24PS
More data for this
Ligand-Target Pair
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial


(Homo sapiens (Human))
BDBM50333025
PNG
(3-(Pyridin-2-ylethynyl)-1H-indazole | CHEMBL163189...)
Show SMILES c1ccc(nc1)C#Cc1n[nH]c2ccccc12
Show InChI InChI=1S/C14H9N3/c1-2-7-13-12(6-1)14(17-16-13)9-8-11-5-3-4-10-15-11/h1-7,10H,(H,16,17)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of PDK1 by Z'-LYTE kinase activity assay


J Med Chem 53: 8368-8375 (2010)


Article DOI: 10.1021/jm100825h
BindingDB Entry DOI: 10.7270/Q2NP24PS
More data for this
Ligand-Target Pair