null

SMILES [C-]#N

InChI Key InChIKey=XFXPMWWXUTWYJX-UHFFFAOYSA-N

PDB links: 190 PDB IDs match this monomer. 9 PDB IDs contain this monomer as substructures. 9 PDB IDs contain inhibitors having a similarity of 90% to 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 4 hits for monomerid = 26984   

TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universita degli Studi di Firenze

LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)copy SMILEScopy InChI
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 Article
BindingDB Entry DOI: 10.7270/Q2KD1W79PubMed
TargetCarbonic anhydrase 15 [19-324](Mus musculus (mouse))
Universita degli Studi di Firenze

LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)copy SMILEScopy InChI
Affinity DataKi:  9.40E+3nMAssay 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 Article
BindingDB Entry DOI: 10.7270/Q2KD1W79PubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universita degli Studi di Firenze

LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)copy SMILEScopy InChI
Affinity DataKi:  2.00E+4nM ΔG°:  -6.30kcal/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 Article
BindingDB Entry DOI: 10.7270/Q2KD1W79PubMed
TargetCarbonic anhydrase 4(Homo sapiens (Human))
Universita degli Studi di Firenze

LigandPNGBDBM26984(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)copy SMILEScopy InChI
Affinity DataKi:  7.70E+5nMAssay 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 Article
BindingDB Entry DOI: 10.7270/Q2KD1W79PubMed