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BDBM50255254 2-(2-methoxyphenyl)-4-(4-methyl-1H-indol-5-ylamino)thieno[2,3-b]pyridine-5-carbonitrile::CHEMBL480839

SMILES: COc1ccccc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N

InChI Key: InChIKey=ZYTAPJWMMBTUHH-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50255254   
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
Tyrosine-protein kinase Lyn


(Homo sapiens (Human))
BDBM50255254
PNG
(2-(2-methoxyphenyl)-4-(4-methyl-1H-indol-5-ylamino...)
Show SMILES COc1ccccc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C24H18N4OS/c1-14-16-9-10-26-20(16)8-7-19(14)28-23-15(12-25)13-27-24-18(23)11-22(30-24)17-5-3-4-6-21(17)29-2/h3-11,13,26H,1-2H3,(H,27,28)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 310n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of Lyn


Bioorg Med Chem Lett 19: 766-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.12.021
BindingDB Entry DOI: 10.7270/Q2KW5FX7
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50255254
PNG
(2-(2-methoxyphenyl)-4-(4-methyl-1H-indol-5-ylamino...)
Show SMILES COc1ccccc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C24H18N4OS/c1-14-16-9-10-26-20(16)8-7-19(14)28-23-15(12-25)13-27-24-18(23)11-22(30-24)17-5-3-4-6-21(17)29-2/h3-11,13,26H,1-2H3,(H,27,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 23n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human full length PKCtheta


Bioorg Med Chem Lett 19: 766-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.12.021
BindingDB Entry DOI: 10.7270/Q2KW5FX7
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50255254
PNG
(2-(2-methoxyphenyl)-4-(4-methyl-1H-indol-5-ylamino...)
Show SMILES COc1ccccc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C24H18N4OS/c1-14-16-9-10-26-20(16)8-7-19(14)28-23-15(12-25)13-27-24-18(23)11-22(30-24)17-5-3-4-6-21(17)29-2/h3-11,13,26H,1-2H3,(H,27,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

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

Similars

Article
PubMed
n/an/a 250n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human full length PKCdelta


Bioorg Med Chem Lett 19: 766-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.12.021
BindingDB Entry DOI: 10.7270/Q2KW5FX7
More data for this
Ligand-Target Pair