Reaction Details Report a problem with these data
Target
Carbonic anhydrase
Ligand
BDBM50607
Substrate
n/a
Meas. Tech.
CA Inhibition Assay
pH
7.4±n/a
Temperature
298.15±n/a K
Ki
76500±n/a nM
Comments
extracted
Citation
Bilginer, S; Unluer, E; Gul, HI; Mete, E; Isik, S; Vullo, D; Ozensoy-Guler, O; Beyaztas, S; Capasso, C; Supuran, CT Carbonic anhydrase inhibitors. Phenols incorporating 2- or 3-pyridyl-ethenylcarbonyl and tertiary amine moieties strongly inhibit Saccharomyces cerevisiae ß-carbonic anhydrase. J Enzyme Inhib Med Chem 29:495-9 (2014) [PubMed] Article
More Info.:
Target
Name:
Carbonic anhydrase
Synonyms:
β-Carbonic anhydrase (CA)
Type:
Enzyme
Mol. Mass.:
24861.97
Organism:
Saccharomyces cerevisiae (Baker's yeast)
Description:
P53615
Residue:
221
Sequence:
MSATESSSIFTLSHNSNLQDILAANAKWASQMNNIQPTLFPDHNAKGQSPHTLFIGCSDSRYNENCLGVLPGEVFTWKNVANICHSEDLTLKATLEFAIICLKVNKVIICGHTDCGGIKTCLTNQREALPKVNCSHLYKYLDDIDTMYHEESQNLIHLKTQREKSHYLSHCNVKRQFNRIIENPTVQTAVQNGELQVYGLLYNVEDGLLQTVSTYTKVTPK
Inhibitor
Name:
BDBM50607
Synonyms:
(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
Type:
Small organic molecule
Emp. Form.:
C14H11NO2
Mol. Mass.:
225.2426
SMILES:
Oc1ccc(cc1)C(=O)\C=C\c1cccnc1