BDBM50503800 CHEMBL4558235

SMILES COc1ccc(\C=N\NC(=O)C2CN(C(=O)C2)c2cc(C)c(c(C)c2)S(N)(=O)=O)cc1

InChI Key InChIKey=QXVXBVRIVQJMHL-FOKLQQMPSA-N

Data  18 Kd

  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 18 hits for monomerid = 50503800   

TargetCarbonic anhydrase 4(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  0.100nMAssay Description:Binding affinity to recombinant human CA4 assessed as intrinsic dissociation constant by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 13(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  2.10E+4nMAssay Description:Binding affinity to recombinant human CA13 by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 6(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  0.210nMAssay Description:Binding affinity to recombinant human CA6 assessed as intrinsic dissociation constant by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 7(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  1.20nMAssay Description:Binding affinity to recombinant human CA7 assessed as intrinsic dissociation constant by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  0.0930nMAssay Description:Binding affinity to recombinant human CA9 assessed as intrinsic dissociation constant by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  0.300nMAssay Description:Binding affinity to recombinant human CA1 assessed as intrinsic dissociation constant by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 5B, mitochondrial(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  0.0550nMAssay Description:Binding affinity to recombinant full length N-terminal His6x-tagged human CA5B expressed in Escherichia coli Rosetta 2 (DE3) assessed as intrinsic di...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  2.00E+3nMAssay Description:Binding affinity to recombinant human CA9 by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  2.00E+3nMAssay Description:Binding affinity to recombinant human CA2 by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  2.00E+3nMAssay Description:Binding affinity to recombinant human CA1 by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 4(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  2.20E+3nMAssay Description:Binding affinity to recombinant human CA4 by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 6(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  1.40E+4nMAssay Description:Binding affinity to recombinant human CA6 by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  0.150nMAssay Description:Binding affinity to recombinant human CA2 assessed as intrinsic dissociation constant by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 12(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  1.10nMAssay Description:Binding affinity to recombinant human CA12 assessed as intrinsic dissociation constant by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 5B, mitochondrial(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  670nMAssay Description:Binding affinity to recombinant full length N-terminal His6x-tagged human CA5B expressed in Escherichia coli Rosetta 2 (DE3) by DSF-based fluorescenc...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 7(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  1.80E+4nMAssay Description:Binding affinity to recombinant human CA7 by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 13(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  3.10nMAssay Description:Binding affinity to recombinant human CA13 assessed as intrinsic dissociation constant by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 12(Homo sapiens (Human))
Kaunas University Of Technology

Curated by ChEMBL
LigandPNGBDBM50503800(CHEMBL4558235)
Affinity DataKd:  1.80E+4nMAssay Description:Binding affinity to recombinant human CA12 by DSF-based fluorescence thermal shift assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed