BDBM50279676 CHEMBL4159776

SMILES OB1OCc2ccc(NC(=S)Nc3ccc(cc3)[N+]([O-])=O)cc12

InChI Key InChIKey=YXDUCEZSXPKKPH-UHFFFAOYSA-N

Data  7 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 7 hits for monomerid = 50279676   

TargetCarbonic anhydrase(Cryptococcus neoformans var. grubii (Filobasidiell...)
University of Montpellier

Curated by ChEMBL
LigandPNGBDBM50279676(CHEMBL4159776)
Affinity DataKi:  79nMAssay Description:Inhibition of Cryptococcus neoformans Can2 incubated for 15 mins prior to testing by stopped flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase(Yeast)
University of Montpellier

Curated by ChEMBL
LigandPNGBDBM50279676(CHEMBL4159776)
Affinity DataKi:  96nMAssay Description:Inhibition of Candida glabrata Nce103 incubated for 15 mins prior to testing by stopped flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Montpellier

Curated by ChEMBL
LigandPNGBDBM50279676(CHEMBL4159776)
Affinity DataKi:  385nMAssay Description:Inhibition of human carbonic anhydrase-1 incubated for 15 mins prior to testing by stopped flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
Long Island University

Curated by ChEMBL
LigandPNGBDBM50279676(CHEMBL4159776)
Affinity DataKi:  504nMAssay Description:Binding affinity to human CA-II assessed as inhibition constant preincubated for 15 mins by bromothymol blue staining based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2023
Entry Details
PubMed
TargetCarbonic anhydrase 1(Human)
University of Montpellier

Curated by ChEMBL
LigandPNGBDBM50279676(CHEMBL4159776)
Affinity DataKi:  6.35E+3nMAssay Description:Binding affinity to human CA-I assessed as inhibition constant preincubated for 15 mins by bromothymol blue staining based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2023
Entry Details
PubMed
TargetCarbonic anhydrase 2(Human)
Long Island University

Curated by ChEMBL
LigandPNGBDBM50279676(CHEMBL4159776)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human carbonic anhydrase-2 incubated for 15 mins prior to testing by stopped flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
Long Island University

Curated by ChEMBL
LigandPNGBDBM50279676(CHEMBL4159776)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human carbonic anhydrase 2 incubated for 30 mins prior to testing measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed