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SMILES: Cc1c(Nc2c(\C=C\CCN3CCC(CC3)c3ccccc3)cncc2C#N)ccc2[nH]ccc12

InChI Key: InChIKey=MOJGUBLPDOMBJL-WEVVVXLNSA-N

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 = 35149   
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))
BDBM35149
PNG
(5-vinyl-3-pyridinecarbonitrile, 31)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CC3)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C30H31N5/c1-22-27-12-15-33-29(27)11-10-28(22)34-30-25(20-32-21-26(30)19-31)9-5-6-16-35-17-13-24(14-18-35)23-7-3-2-4-8-23/h2-5,7-12,15,20-21,24,33H,6,13-14,16-18H2,1H3,(H,32,34)/b9-5+
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 77n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35149
PNG
(5-vinyl-3-pyridinecarbonitrile, 31)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CC3)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C30H31N5/c1-22-27-12-15-33-29(27)11-10-28(22)34-30-25(20-32-21-26(30)19-31)9-5-6-16-35-17-13-24(14-18-35)23-7-3-2-4-8-23/h2-5,7-12,15,20-21,24,33H,6,13-14,16-18H2,1H3,(H,32,34)/b9-5+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 19n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair