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BDBM50258388 5-(4-(2-(2-(dimethylamino)ethylamino)ethoxy)phenyl)-4-(4-methyl-1H-indol-5-ylamino)nicotinonitrile::CHEMBL494166

SMILES: CN(C)CCNCCOc1ccc(cc1)-c1cncc(C#N)c1Nc1ccc2[nH]ccc2c1C

InChI Key: InChIKey=ZRTHIYZKVPIBMW-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50258388   
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
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50258388
PNG
(5-(4-(2-(2-(dimethylamino)ethylamino)ethoxy)phenyl...)
Show SMILES CN(C)CCNCCOc1ccc(cc1)-c1cncc(C#N)c1Nc1ccc2[nH]ccc2c1C
Show InChI InChI=1S/C27H30N6O/c1-19-23-10-11-31-26(23)9-8-25(19)32-27-21(16-28)17-30-18-24(27)20-4-6-22(7-5-20)34-15-13-29-12-14-33(2)3/h4-11,17-18,29,31H,12-15H2,1-3H3,(H,30,32)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human PKCdelta by IMAP assay


Bioorg Med Chem Lett 19: 3623-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.126
BindingDB Entry DOI: 10.7270/Q29W0FD4
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50258388
PNG
(5-(4-(2-(2-(dimethylamino)ethylamino)ethoxy)phenyl...)
Show SMILES CN(C)CCNCCOc1ccc(cc1)-c1cncc(C#N)c1Nc1ccc2[nH]ccc2c1C
Show InChI InChI=1S/C27H30N6O/c1-19-23-10-11-31-26(23)9-8-25(19)32-27-21(16-28)17-30-18-24(27)20-4-6-22(7-5-20)34-15-13-29-12-14-33(2)3/h4-11,17-18,29,31H,12-15H2,1-3H3,(H,30,32)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.90n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human PKCtheta by IMAP assay


Bioorg Med Chem Lett 19: 3623-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.126
BindingDB Entry DOI: 10.7270/Q29W0FD4
More data for this
Ligand-Target Pair