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BDBM50185252 2-(2-aminophenyl)quinazolin-4-amine::CHEMBL206398

SMILES: Nc1ccccc1-c1nc(N)c2ccccc2n1

InChI Key: InChIKey=AWFUCSSIHIBPBQ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50185252   
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
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50185252
PNG
(2-(2-aminophenyl)quinazolin-4-amine | CHEMBL206398)
Show SMILES Nc1ccccc1-c1nc(N)c2ccccc2n1
Show InChI InChI=1S/C14H12N4/c15-11-7-3-1-5-9(11)14-17-12-8-4-2-6-10(12)13(16)18-14/h1-8H,15H2,(H2,16,17,18)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.69E+5n/an/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Inhibition of human CYP2D6 expressed in Escherichia coli JM109


J Med Chem 49: 2417-30 (2006)


Article DOI: 10.1021/jm0508538
BindingDB Entry DOI: 10.7270/Q2930TZX
More data for this
Ligand-Target Pair