BDBM26984 CHEMBL1644697::CN(-1)::cyanide::iminomethanide

SMILES [C-]#N

InChI Key InChIKey=XFXPMWWXUTWYJX-UHFFFAOYSA-N

Data  40 KI

PDB links: 190 PDB IDs match this monomer.

  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 9 hits for monomerid = 26984   

TargetCarbonic anhydrase 1(Homo sapiens (Human))
Istituto Di Bioscienze E Biorisorse (Ibbr)-Cnr

Curated by ChEMBL
LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Affinity DataKi:  500nMAssay Description:Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Istituto Di Bioscienze E Biorisorse (Ibbr)-Cnr

Curated by ChEMBL
LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Affinity DataKi:  500nMpH: 7.5Assay Description:Inhibition of human carbonic anhydrase 1 after 15 mins by CO2 hydrase assay at pH 7.5More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Istituto Di Bioscienze E Biorisorse (Ibbr)-Cnr

Curated by ChEMBL
LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Affinity DataKi:  500nMAssay Description:Inhibition of human carbonic anhydrase-1 at 20 degC preincubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Istituto Di Bioscienze E Biorisorse (Ibbr)-Cnr

Curated by ChEMBL
LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Affinity DataKi:  500nMAssay Description:Inhibition of human cytosolic carbonic anhydrase 1 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))
Istituto Di Bioscienze E Biorisorse (Ibbr)-Cnr

Curated by ChEMBL
LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Affinity DataKi:  500nM ΔG°:  -8.45kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Istituto Di Bioscienze E Biorisorse (Ibbr)-Cnr

Curated by ChEMBL
LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Affinity DataKi:  500nMAssay Description:Inhibition of human recombinant wild type CA1 by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Istituto Di Bioscienze E Biorisorse (Ibbr)-Cnr

Curated by ChEMBL
LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Affinity DataKi:  500nMAssay Description:Inhibition of human carbonic anhydrase 1 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))
Istituto Di Bioscienze E Biorisorse (Ibbr)-Cnr

Curated by ChEMBL
LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Affinity DataKi:  500nM ΔG°:  -8.45kcal/molepH: 7.5 T: 2°CAssay Description:Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Istituto Di Bioscienze E Biorisorse (Ibbr)-Cnr

Curated by ChEMBL
LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Affinity DataKi:  500nMpH: 8.3Assay Description:Inhibition of recombinant human carbonic anhydrase 1 after 15 mins by stopped flow CO2 hydration assay at pH 8.3More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed