BDBM50158530 CHEMBL3786477

SMILES NS(=O)(=O)c1cccc(c1)\N=C1/C(=O)Nc2ccc(OC(F)(F)F)cc12

InChI Key InChIKey=VHMRTDMHGBJAOX-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 50158530   

TargetCarbonic anhydrase(Candida glabrata)
Bezmialem Vakif University

Curated by ChEMBL
LigandPNGBDBM50158530(CHEMBL3786477)
Affinity DataKi:  54nMAssay Description:Inhibition of recombinant Candida glabrata beta carbonic anhydrase NCE103 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase(Candida albicans (Yeast))
Bezmialem Vakif University

Curated by ChEMBL
LigandPNGBDBM50158530(CHEMBL3786477)
Affinity DataKi:  88nMAssay Description:Inhibition of recombinant Candida albicans beta carbonic anhydrase NCE103 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Bezmialem Vakif University

Curated by ChEMBL
LigandPNGBDBM50158530(CHEMBL3786477)
Affinity DataKi:  484nMAssay Description:Inhibition of recombinant human carbonic anhydrase 2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Bezmialem Vakif University

Curated by ChEMBL
LigandPNGBDBM50158530(CHEMBL3786477)
Affinity DataKi:  539nMAssay Description:Inhibition of recombinant human carbonic anhydrase 1 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed