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BDBM50313582 (E)-4-(4-methyl-1H-indol-5-ylamino)-5-(3-(morpholinomethyl)styryl)nicotinonitrile::CHEMBL1086419

SMILES: Cc1c(Nc2c(\C=C\c3cccc(CN4CCOCC4)c3)cncc2C#N)ccc2[nH]ccc12

InChI Key: InChIKey=FPSGCBWWRUZTIV-AATRIKPKSA-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 = 50313582   
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))
BDBM50313582
PNG
((E)-4-(4-methyl-1H-indol-5-ylamino)-5-(3-(morpholi...)
Show SMILES Cc1c(Nc2c(\C=C\c3cccc(CN4CCOCC4)c3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C28H27N5O/c1-20-25-9-10-31-27(25)8-7-26(20)32-28-23(17-30-18-24(28)16-29)6-5-21-3-2-4-22(15-21)19-33-11-13-34-14-12-33/h2-10,15,17-18,31H,11-14,19H2,1H3,(H,30,32)/b6-5+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 300n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 20: 1965-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.119
BindingDB Entry DOI: 10.7270/Q2H70FX5
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50313582
PNG
((E)-4-(4-methyl-1H-indol-5-ylamino)-5-(3-(morpholi...)
Show SMILES Cc1c(Nc2c(\C=C\c3cccc(CN4CCOCC4)c3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C28H27N5O/c1-20-25-9-10-31-27(25)8-7-26(20)32-28-23(17-30-18-24(28)16-29)6-5-21-3-2-4-22(15-21)19-33-11-13-34-14-12-33/h2-10,15,17-18,31H,11-14,19H2,1H3,(H,30,32)/b6-5+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.20n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 20: 1965-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.119
BindingDB Entry DOI: 10.7270/Q2H70FX5
More data for this
Ligand-Target Pair