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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Ephrin type-A receptor 4' and Ligand = 'BDBM44436'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ephrin type-A receptor 4


(Mus musculus)
BDBM44436
PNG
(3-phenyl-1-propyl-pyrazolo[4,3-b]quinoxaline | 3-p...)
Show SMILES CCCn1nc(-c2ccccc2)c2nc3ccccc3nc12
Show InChI InChI=1S/C18H16N4/c1-2-12-22-18-17(16(21-22)13-8-4-3-5-9-13)19-14-10-6-7-11-15(14)20-18/h3-11H,2,12H2,1H3
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.03E+4n/an/an/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2P55KW4
More data for this
Ligand-Target Pair
Ephrin type-A receptor 4


(Mus musculus)
BDBM44436
PNG
(3-phenyl-1-propyl-pyrazolo[4,3-b]quinoxaline | 3-p...)
Show SMILES CCCn1nc(-c2ccccc2)c2nc3ccccc3nc12
Show InChI InChI=1S/C18H16N4/c1-2-12-22-18-17(16(21-22)13-8-4-3-5-9-13)19-14-10-6-7-11-15(14)20-18/h3-11H,2,12H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2JD4V5T
More data for this
Ligand-Target Pair