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BDBM6413 (3-Chloro-phenyl)-{6-[5-(3-phenyl-propylamino)-pyridin-3-yl]-pyrazin-2-yl}-amine::N-(3-chlorophenyl)-6-{5-[(3-phenylpropyl)amino]pyridin-3-yl}pyrazin-2-amine::Pyrazine-Pyridine Biheteroaryl 59

SMILES: Clc1cccc(Nc2cncc(n2)-c2cncc(NCCCc3ccccc3)c2)c1

InChI Key: InChIKey=NNTGNPPBTNKLPC-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 6413   
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
VEGFR-2 (KDR)


(Rattus norvegicus (rat))
BDBM6413
PNG
((3-Chloro-phenyl)-{6-[5-(3-phenyl-propylamino)-pyr...)
Show SMILES Clc1cccc(Nc2cncc(n2)-c2cncc(NCCCc3ccccc3)c2)c1
Show InChI InChI=1S/C24H22ClN5/c25-20-9-4-10-21(13-20)29-24-17-27-16-23(30-24)19-12-22(15-26-14-19)28-11-5-8-18-6-2-1-3-7-18/h1-4,6-7,9-10,12-17,28H,5,8,11H2,(H,29,30)
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KEGG

UniProtKB/SwissProt

B.MOAD
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AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.28E+3n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical



Assay Description
The enzyme was assayed with a biotinylated peptide substrate and test compounds in the presence of 5 uM ATP/[gamma-33P]ATP in a streptavidin coated F...


J Med Chem 48: 4892-909 (2005)


Article DOI: 10.1021/jm058205b
BindingDB Entry DOI: 10.7270/Q2NC5ZD5
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 1 (CDK1)


(Homo sapiens (Human))
BDBM6413
PNG
((3-Chloro-phenyl)-{6-[5-(3-phenyl-propylamino)-pyr...)
Show SMILES Clc1cccc(Nc2cncc(n2)-c2cncc(NCCCc3ccccc3)c2)c1
Show InChI InChI=1S/C24H22ClN5/c25-20-9-4-10-21(13-20)29-24-17-27-16-23(30-24)19-12-22(15-26-14-19)28-11-5-8-18-6-2-1-3-7-18/h1-4,6-7,9-10,12-17,28H,5,8,11H2,(H,29,30)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical



Assay Description
The enzyme was assayed with a biotinylated peptide substrate and test compounds in the presence of 5 uM ATP/[gamma-33P]ATP in a streptavidin coated F...


J Med Chem 48: 4892-909 (2005)


Article DOI: 10.1021/jm058205b
BindingDB Entry DOI: 10.7270/Q2NC5ZD5
More data for this
Ligand-Target Pair