BDBM26983 CHEMBL1644028::SCN(-1)::Thiocyanate::cyanosulfanide::sodium thiocyanate

SMILES [N-]=C=S

InChI Key InChIKey=ZBKFYXZXZJPWNQ-UHFFFAOYSA-N

Data  43 KI  2 ITC

PDB links: 492 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 43 hits for monomerid = 26983   

TargetCarbonic anhydrase 15 [19-324](Mus musculus (mouse))
Universita Degli Studi Di Firenze

LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.01E+4nMAssay 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 9(Homo sapiens (Human))
Ondokuz Mayis University

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.30E+5nMAssay Description:Inhibition of human carbonic anhydrase 9 by Lineweaver-Burk curvesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Ondokuz Mayis University

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.30E+5nMAssay Description:Inhibition constant of anion against human carbonic anhydrase isozyme hCA IXMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 7(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.70E+5nMAssay Description:Inhibition of human recombinant CA7More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMAssay 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))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMAssay 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))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMAssay Description:Inhibition of human carbonic anhydrase 1 by Lineweaver-Burk curvesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMAssay 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))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMpH: 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))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMAssay Description:Inhibitory activity against human carbonic anhydrase I expressed in Escherichia coliChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMAssay Description:Inhibition of human recombinant CA1 by stopped-flow CO2 hydration assayChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMAssay Description:Inhibitory constant against carbonic anhydrase IMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMpH: 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
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nMAssay Description:Inhibition constant of anion against human carbonic anhydrase isozyme hCA IMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  2.00E+5nM ΔG°:  -4.96kcal/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(Stylophora pistillata)
Centre Scientifique De Monaco

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  5.10E+5nMAssay Description:Inhibition of Stylophora pistillata carbonic anhydrase 2 by stopped-flow CO2 hydration assayChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase(Methanobacterium thermoautotrophicum)
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  5.20E+5nMAssay Description:Inhibitory constant against methanoarchaeon Methanobacterium thermoautotrophicum (Cab)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase(Astrosclera willeyana)
Slovak Academy Of Sciences

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  6.70E+5nMAssay Description:Inhibition of Astrosclera willeyana recombinant GST-tagged astrosclerin 3 expressed in Escherichia coli BL21-DE3-RIPL cells preincubated for 15 mins ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase(Stylophora pistillata)
Centre Scientifique De Monaco

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  6.80E+5nMAssay Description:Inhibition of Stylophora pistillata carbonic anhydrase by stopped-flow CO2 hydration assayChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 5A, mitochondrial(Homo sapiens (Human))
Ondokuz Mayis University

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  7.40E+5nMAssay Description:Inhibition of human carbonic anhydrase 5 by Lineweaver-Burk curvesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 13(Mus musculus (mouse))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  7.40E+5nMAssay Description:Inhibitory activity against mouse carbonic anhydrase XIII expressed in Escherichia coli TOP 10Checked by AuthorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 6(Homo sapiens (Human))
Centre Scientifique De Monaco

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  8.90E+5nMAssay Description:Inhibition of human recombinant CA6 by stopped-flow CO2 hydration assayChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of human recombinant wild type CA2 by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by CO2 hydration stopped-flow assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of human cytosolic carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition constant of anion against human carbonic anhydrase isozyme hCA IIMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibitory activity against human carbonic anhydrase II expressed in Escherichia coliChecked by AuthorMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibitory constant against carbonic anhydrase IIMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMpH: 8.3Assay Description:Inhibition of recombinant human carbonic anhydrase 2 after 15 mins by stopped flow CO2 hydration assay at pH 8.3More data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMpH: 7.5Assay Description:Inhibition of human carbonic anhydrase 2 after 15 mins by CO2 hydrase assay at pH 7.5More data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of human recombinant CA2 by stopped-flow CO2 hydration assayChecked by AuthorMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nM ΔG°:  -3.75kcal/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
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of human CA2 incubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of human carbonic anhydrase 2 by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of recombinant human carbonic anhydrase 2 assessed as inhibition of CO2 hydration incubated for 15 mins prior to testing by stopped flow C...More data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  1.60E+6nMAssay Description:Inhibition of human carbonic anhydrase 2 by Lineweaver-Burk curvesMore data for this Ligand-Target Pair
TargetCarbonic anhydrase(Methanosarcina thermophila)
Istituto Di Biochimica Delle Proteine-Cnr

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  7.00E+6nMAssay Description:Inhibition of Methanosarcina thermophila recombinant gamma-CA by CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase(Methanosarcina thermophila)
Istituto Di Biochimica Delle Proteine-Cnr

Curated by ChEMBL
LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  7.00E+6nMAssay Description:Inhibitory constant against Zn-Cam (Methanosarcina thermophila)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 4(Homo sapiens (Human))
Universita Degli Studi Di Firenze

LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  3.90E+7nMAssay 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 4(Homo sapiens (Human))
Universita Degli Studi Di Firenze

LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  3.90E+7nMAssay Description:Inhibition of human carbonic anhydrase 4 by Lineweaver-Burk curvesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 4(Homo sapiens (Human))
Universita Degli Studi Di Firenze

LigandPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
Affinity DataKi:  3.90E+7nMAssay Description:Inhibition constant of anion against human carbonic anhydrase isozyme hCA IVMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 2 hits for monomerid = 26983   

HostPNGBDBM36127(6-Amino-6-deoxy-beta-cyclodextrin (am-beta-CD) | 6...)
Japan Science And Technology Agency

GuestPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
ITC DataΔG°: -1.36kcal/mole −TΔS°: 2.63kcal/mole ΔH°: -3.94kcal/mole logk: 10
pH: 6.9 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Japan Science And Technology Agency

GuestPNGBDBM26983(CHEMBL1644028 | SCN(-1) | Thiocyanate | cyanosulfa...)
ITC DataΔG°: -0.955kcal/mole −TΔS°: 3.35kcal/mole ΔH°: -4.30kcal/mole logk: 5
pH: 6.9 T: 25.00°C