Brief Information of the Compound and Protein
Compound Name
(E)-3-(3,5-Dimethoxyphenyl)-1-(pyridin-4-yl)prop-2-en-1-one
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PubChem ID
CID: 118491258
Canonical SMILES
COc1cc(/C=C/C(=O)c2ccncc2)cc(OC)c1
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Compound Formula C16H15NO3
Compound Structure
Protein Name
Cytochrome P450 1B1
Protein Classification
Enzyme
>
Cytochrome P450
>
Cytochrome P450 family 1
>
Cytochrome P450 family 1B
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Cytochrome P450 1B1
Uniprot ID
Q16678
Gene Name
CYP1B1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  2
1
EC50 = 10000 nM
   TI
   LI
   LO
   TS
2
IC50 = 31 nM
   TI
   LI
   LO
   TS