BDBM248154 CA standard inhibitor, 13

SMILES OCCNCc1cc(ccc1O)C(=O)\C=C\c1ccccn1

InChI Key InChIKey=NAKUEVSZDJJJKC-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 248154   

TargetCarbonic anhydrase 1(Human)
Ataturk University

LigandPNGBDBM248154(CA standard inhibitor, 13)
Affinity DataKi:  910nM ΔG°:  -8.24kcal/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 Depth
Date in BDB:
9/6/2017
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
Ataturk University

LigandPNGBDBM248154(CA standard inhibitor, 13)
Affinity DataKi:  5.24E+4nM ΔG°:  -5.84kcal/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 Depth
Date in BDB:
9/6/2017
Entry Details Article
PubMed
TargetCarbonic anhydrase(Baker's yeast)
Ataturk University

LigandPNGBDBM248154(CA standard inhibitor, 13)
Affinity DataKi:  9.54E+4nM ΔG°:  -5.48kcal/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 Depth
Date in BDB:
9/6/2017
Entry Details Article
PubMed