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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 1A1' and Monomerid = 50131042   
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
Cytochrome P450 1A1


(Homo sapiens (Human))
BDBM50131042
PNG
(3-Bromo-8,13-dihydro-7H-indolo[2',3':3,4]pyrido[2,...)
Show SMILES Brc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1
Show InChI InChI=1S/C18H12BrN3O/c19-10-5-6-15-13(9-10)18(23)22-8-7-12-11-3-1-2-4-14(11)20-16(12)17(22)21-15/h1-6,9,20H,7-8H2
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Similars

Article
PubMed
n/an/a 2.47E+3n/an/an/an/an/an/a



National Research Institute of Chinese Medicine

Curated by ChEMBL


Assay Description
Inhibition of Cytochrome P450 1A1 enzyme in bacterial membrane expressing human P450s


Bioorg Med Chem Lett 13: 2535-8 (2003)


Article DOI: 10.1016/s0960-894x(03)00469-4
BindingDB Entry DOI: 10.7270/Q2805341
More data for this
Ligand-Target Pair