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BDBM35133 5-vinyl-3-pyridinecarbonitrile, 15c

SMILES: Cc1c(Nc2c(\C=C\CCCN3CCC(O)CC3)cncc2C#N)ccc2[nH]ccc12

InChI Key: InChIKey=LCLDOTQNYVMPRQ-HWKANZROSA-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 = 35133   
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))
BDBM35133
PNG
(5-vinyl-3-pyridinecarbonitrile, 15c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCC(O)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H29N5O/c1-18-22-8-11-28-24(22)7-6-23(18)29-25-19(16-27-17-20(25)15-26)5-3-2-4-12-30-13-9-21(31)10-14-30/h3,5-8,11,16-17,21,28,31H,2,4,9-10,12-14H2,1H3,(H,27,29)/b5-3+
PDB
MMDB

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KEGG

UniProtKB/SwissProt
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B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 62n/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))
BDBM35133
PNG
(5-vinyl-3-pyridinecarbonitrile, 15c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCC(O)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H29N5O/c1-18-22-8-11-28-24(22)7-6-23(18)29-25-19(16-27-17-20(25)15-26)5-3-2-4-12-30-13-9-21(31)10-14-30/h3,5-8,11,16-17,21,28,31H,2,4,9-10,12-14H2,1H3,(H,27,29)/b5-3+
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 11n/an/an/an/a7.222



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