BDBM50570979 CHEMBL4876038

SMILES COc1cccc(C2CC(=NN2c2ccc(cc2)S(N)(=O)=O)c2cc(F)ccc2F)c1OC

InChI Key InChIKey=NDXDTKKYWMJWOB-UHFFFAOYSA-N

Data  7 KI  7 IC50

  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 14 hits for monomerid = 50570979   

TargetCarbonic anhydrase 1(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataIC50: 4.10nMAssay Description:Inhibition of human CA1 by stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 2(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataIC50: 5.60nMAssay Description:Inhibition of human CA2 by stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 1(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataIC50: 3.80nMAssay Description:Inhibition of human CA1 by spectrophotometer based analysisMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCarbonic anhydrase 2(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataIC50: 4.5nMAssay Description:Inhibition of human CA2 by spectrophotometer based analysisMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCarbonic anhydrase 1(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataIC50: 3.80nMAssay Description:Inhibition of human CA1More data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCarbonic anhydrase 2(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataIC50: 4.5nMAssay Description:Inhibition of human CA2More data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetAcetylcholinesterase(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataIC50: 6.40nMAssay Description:Inhibition of AChE (unknown origin)More data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCarbonic anhydrase 1(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataKi:  3.30nMAssay Description:Binding affinity to human CA1 assessed as inhibition constant by Lineweaver-Burk plot analysisMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCarbonic anhydrase 1(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataKi:  3.30nMAssay Description:Inhibition of human CA1More data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetAcetylcholinesterase(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataKi:  3.30nMAssay Description:Inhibition of AChE (unknown origin)More data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCarbonic anhydrase 1(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataKi:  3.80nMAssay Description:Inhibition of human CA1 by stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 2(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataKi:  4.30nMAssay Description:Binding affinity to human CA2 assessed as inhibition constant by Lineweaver-Burk plot analysisMore data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCarbonic anhydrase 2(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataKi:  4.30nMAssay Description:Inhibition of human CA2More data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetCarbonic anhydrase 2(Human)
Georgia State University

Curated by ChEMBL
LigandPNGBDBM50570979(CHEMBL4876038)
Affinity DataKi:  6.20nMAssay Description:Inhibition of human CA2 by stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed