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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Heme oxygenase 2' and Ligand = 'BDBM50441445'   
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
Heme oxygenase 2


(Rattus norvegicus (rat))
BDBM50441445
PNG
(CHEMBL2436270)
Show SMILES C(N1CCCC1)c1nc2ccccc2n1C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H25N3/c1-3-11-20(12-4-1)25(21-13-5-2-6-14-21)28-23-16-8-7-15-22(23)26-24(28)19-27-17-9-10-18-27/h1-8,11-16,25H,9-10,17-19H2
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 4.10E+3n/an/an/an/an/an/a



Queen's University

Curated by ChEMBL


Assay Description
Inhibition of HO-2 in Sprague-Dawley rat brain microsomal fractions assessed as carbon monoxide formation from methemalbumin after 10 mins by gas chr...


Bioorg Med Chem 21: 6788-95 (2013)


Article DOI: 10.1016/j.bmc.2013.07.050
BindingDB Entry DOI: 10.7270/Q27082VV
More data for this
Ligand-Target Pair