BDBM50607 (E)-1-(4-Hydroxy-phenyl)-3-pyridin-3-yl-propenone::(E)-1-(4-hydroxyphenyl)-3-(3-pyridinyl)-2-propen-1-one::(E)-1-(4-hydroxyphenyl)-3-(3-pyridyl)prop-2-en-1-one::(E)-1-(4-hydroxyphenyl)-3-pyridin-3-yl-prop-2-en-1-one::(E)-1-(4-hydroxyphenyl)-3-pyridin-3-ylprop-2-en-1-one::CA standard inhibitor, 1::MLS000778012::SMR000414406::cid_5920835

SMILES Oc1ccc(cc1)C(=O)\C=C\c1cccnc1

InChI Key InChIKey=JRNSRWHZOUBRQN-FPYGCLRLSA-N

Data  3 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50607   

TargetCarbonic anhydrase 1(Homo sapiens (Human))
Ataturk University

LigandPNGBDBM50607((E)-1-(4-Hydroxy-phenyl)-3-pyridin-3-yl-propenone ...)
Affinity DataKi:  780nM ΔG°:  -8.33kcal/molepH: 7.4 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalyzed CO2 hydration activity [Khalifah et al., J. Biol. Chem., ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Ataturk University

LigandPNGBDBM50607((E)-1-(4-Hydroxy-phenyl)-3-pyridin-3-yl-propenone ...)
Affinity DataKi:  1.25E+4nM ΔG°:  -6.68kcal/molepH: 7.4 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalyzed CO2 hydration activity [Khalifah et al., J. Biol. Chem., ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase(Saccharomyces cerevisiae (Baker's yeast))
Ataturk University

LigandPNGBDBM50607((E)-1-(4-Hydroxy-phenyl)-3-pyridin-3-yl-propenone ...)
Affinity DataKi:  7.65E+4nM ΔG°:  -5.61kcal/molepH: 7.4 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalyzed CO2 hydration activity [Khalifah et al., J. Biol. Chem., ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM50607((E)-1-(4-Hydroxy-phenyl)-3-pyridin-3-yl-propenone ...)
Affinity DataIC50:  5.40E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay