BDBM50456055 CHEMBL4202789

SMILES CC(C)Cc1ccc(cc1)C(C)C(=O)NCCCCOc1ccc(cc1)S(N)(=O)=O

InChI Key InChIKey=LELPHLASVPCEJD-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 = 50456055   

TargetCarbonic anhydrase 12(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456055(CHEMBL4202789)
Affinity DataKi:  6.60nMAssay 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 9(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456055(CHEMBL4202789)
Affinity DataKi:  14nMAssay 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 1(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456055(CHEMBL4202789)
Affinity DataKi:  48nMAssay 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 2(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456055(CHEMBL4202789)
Affinity DataKi:  285nMAssay 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 4(Human)
Ege University Bornova

Curated by ChEMBL
LigandPNGBDBM50456055(CHEMBL4202789)
Affinity DataKi:  2.80E+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