BDBM50456054 CHEMBL4215319

SMILES C[S+]([O-])c1ccc(\C=C2/C(C)=C(CC(=O)NCCOc3ccc(cc3)S(N)(=O)=O)c3cc(F)ccc23)cc1

InChI Key InChIKey=SKOXNUJTXFITBK-UHFFFAOYSA-N

Data  5 KI

  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 5 hits for monomerid = 50456054   

TargetCarbonic anhydrase 2(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456054(CHEMBL4215319)
Affinity DataKi:  7.5nMAssay Description:Inhibition of recombinant human carbonic anhydrase-2 incubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/16/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456054(CHEMBL4215319)
Affinity DataKi:  65nMAssay Description:Inhibition of recombinant human carbonic anhydrase-12 incubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/16/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456054(CHEMBL4215319)
Affinity DataKi:  87nMAssay Description:Inhibition of recombinant human carbonic anhydrase-1 incubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/16/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456054(CHEMBL4215319)
Affinity DataKi:  103nMAssay Description:Inhibition of recombinant human carbonic anhydrase-9 catalytic domain incubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/16/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 4(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456054(CHEMBL4215319)
Affinity DataKi:  6.00E+3nMAssay Description:Inhibition of recombinant human carbonic anhydrase-4 incubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/16/2020
Entry Details Article
PubMed