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BDBM50132133 5-p-Tolyl-1H-pyrazole-3-carboxylic acid::CHEMBL341154::cid_818267

SMILES: Cc1ccc(cc1)-c1cc([nH]n1)C(O)=O

InChI Key: InChIKey=BGTWUOQARPOYER-UHFFFAOYSA-N

Data: 5 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50132133   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Hydroxycarboxylic acid receptor 2


(Rattus norvegicus)
BDBM50132133
PNG
(5-p-Tolyl-1H-pyrazole-3-carboxylic acid | CHEMBL34...)
Show SMILES Cc1ccc(cc1)-c1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C11H10N2O2/c1-7-2-4-8(5-3-7)9-6-10(11(14)15)13-12-9/h2-6H,1H3,(H,12,13)(H,14,15)
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Article
PubMed
3.79E+4n/an/an/an/an/an/an/an/a



Leiden/Amsterdam Center for Drug Research

Curated by ChEMBL


Assay Description
Inhibition of [3H]-nicotinic acid (20 nM) binding to nicotinic acid receptor in rat spleen membrane.


J Med Chem 46: 3945-51 (2003)


Article DOI: 10.1021/jm030888c
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50132133
PNG
(5-p-Tolyl-1H-pyrazole-3-carboxylic acid | CHEMBL34...)
Show SMILES Cc1ccc(cc1)-c1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C11H10N2O2/c1-7-2-4-8(5-3-7)9-6-10(11(14)15)13-12-9/h2-6H,1H3,(H,12,13)(H,14,15)
PDB
MMDB

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>5.00E+4n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 expressed in Escherichia coli preincubated for 15 mins by stopped flow CO2 hydration method


Bioorg Med Chem 23: 4649-59 (2015)


Article DOI: 10.1016/j.bmc.2015.05.052
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50132133
PNG
(5-p-Tolyl-1H-pyrazole-3-carboxylic acid | CHEMBL34...)
Show SMILES Cc1ccc(cc1)-c1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C11H10N2O2/c1-7-2-4-8(5-3-7)9-6-10(11(14)15)13-12-9/h2-6H,1H3,(H,12,13)(H,14,15)
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MMDB

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>5.00E+4n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 expressed in Escherichia coli preincubated for 15 mins by stopped flow CO2 hydration method


Bioorg Med Chem 23: 4649-59 (2015)


Article DOI: 10.1016/j.bmc.2015.05.052
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50132133
PNG
(5-p-Tolyl-1H-pyrazole-3-carboxylic acid | CHEMBL34...)
Show SMILES Cc1ccc(cc1)-c1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C11H10N2O2/c1-7-2-4-8(5-3-7)9-6-10(11(14)15)13-12-9/h2-6H,1H3,(H,12,13)(H,14,15)
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MMDB

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>5.00E+4n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 expressed in Escherichia coli preincubated for 15 mins by stopped flow CO2 hydration method


Bioorg Med Chem 23: 4649-59 (2015)


Article DOI: 10.1016/j.bmc.2015.05.052
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50132133
PNG
(5-p-Tolyl-1H-pyrazole-3-carboxylic acid | CHEMBL34...)
Show SMILES Cc1ccc(cc1)-c1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C11H10N2O2/c1-7-2-4-8(5-3-7)9-6-10(11(14)15)13-12-9/h2-6H,1H3,(H,12,13)(H,14,15)
PDB
MMDB

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PC sid
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Article
PubMed
>5.00E+4n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 expressed in Escherichia coli preincubated for 15 mins by stopped flow CO2 hydration method


Bioorg Med Chem 23: 4649-59 (2015)


Article DOI: 10.1016/j.bmc.2015.05.052
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM50132133
PNG
(5-p-Tolyl-1H-pyrazole-3-carboxylic acid | CHEMBL34...)
Show SMILES Cc1ccc(cc1)-c1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C11H10N2O2/c1-7-2-4-8(5-3-7)9-6-10(11(14)15)13-12-9/h2-6H,1H3,(H,12,13)(H,14,15)
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PCBioAssay
n/an/a 8.71E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair