BDBM45837 3-(2,4-dimethylphenyl)-1H-pyrazole-5-carboxylic acid::MLS-0091993.0001::cid_4274816

SMILES Cc1ccc(-c2cc([nH]n2)C(O)=O)c(C)c1

InChI Key InChIKey=XSEUPOAEAAAQGG-UHFFFAOYSA-N

Data  4 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 45837   

TargetAlkaline phosphatase, tissue-nonspecific isozyme(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM45837(MLS-0091993.0001 | cid_4274816 | 3-(2,4-dimethylph...)
Affinity DataIC50: 3.34E+3nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay
TargetCarbonic anhydrase 9(Human)
University of Belgrade

Curated by ChEMBL
LigandPNGBDBM45837(MLS-0091993.0001 | cid_4274816 | 3-(2,4-dimethylph...)
Affinity DataKi:  4.50E+4nMAssay Description:Inhibition of human recombinant carbonic anhydrase 9 expressed in Escherichia coli preincubated for 15 mins by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/18/2016
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Belgrade

Curated by ChEMBL
LigandPNGBDBM45837(MLS-0091993.0001 | cid_4274816 | 3-(2,4-dimethylph...)
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human recombinant carbonic anhydrase 1 expressed in Escherichia coli preincubated for 15 mins by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/18/2016
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Belgrade

Curated by ChEMBL
LigandPNGBDBM45837(MLS-0091993.0001 | cid_4274816 | 3-(2,4-dimethylph...)
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human recombinant carbonic anhydrase 2 expressed in Escherichia coli preincubated for 15 mins by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/18/2016
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
University of Belgrade

Curated by ChEMBL
LigandPNGBDBM45837(MLS-0091993.0001 | cid_4274816 | 3-(2,4-dimethylph...)
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human recombinant carbonic anhydrase 12 expressed in Escherichia coli preincubated for 15 mins by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/18/2016
Entry Details Article
PubMed