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BDBM6400 5-[6-(3-Chloro-phenylamino)-pyrazin-2-yl]-N-(3-hydroxy-propyl)-nicotinamide::5-{6-[(3-chlorophenyl)amino]pyrazin-2-yl}-N-(3-hydroxypropyl)pyridine-3-carboxamide::Pyrazine-Pyridine Biheteroaryl 43

SMILES: OCCCNC(=O)c1cncc(c1)-c1cncc(Nc2cccc(Cl)c2)n1

InChI Key: InChIKey=CQKZPPUFUROCPO-UHFFFAOYSA-N

Data: 2 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 6400   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
VEGFR-2 (KDR)


(Rattus norvegicus (rat))
BDBM6400
PNG
(5-[6-(3-Chloro-phenylamino)-pyrazin-2-yl]-N-(3-hyd...)
Show SMILES OCCCNC(=O)c1cncc(c1)-c1cncc(Nc2cccc(Cl)c2)n1
Show InChI InChI=1S/C19H18ClN5O2/c20-15-3-1-4-16(8-15)24-18-12-22-11-17(25-18)13-7-14(10-21-9-13)19(27)23-5-2-6-26/h1,3-4,7-12,26H,2,5-6H2,(H,23,27)(H,24,25)
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Article
PubMed
n/an/a 2.38E+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))
BDBM6400
PNG
(5-[6-(3-Chloro-phenylamino)-pyrazin-2-yl]-N-(3-hyd...)
Show SMILES OCCCNC(=O)c1cncc(c1)-c1cncc(Nc2cccc(Cl)c2)n1
Show InChI InChI=1S/C19H18ClN5O2/c20-15-3-1-4-16(8-15)24-18-12-22-11-17(25-18)13-7-14(10-21-9-13)19(27)23-5-2-6-26/h1,3-4,7-12,26H,2,5-6H2,(H,23,27)(H,24,25)
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GoogleScholar
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