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BDBM114880 2-[(2-methylpyrazole-3-carbonyl)amino]benzoic acid methyl ester::2-[[(2-methyl-3-pyrazolyl)-oxomethyl]amino]benzoic acid methyl ester::MLS000679455::SMR000297602::cid_6466448::methyl 2-[(2-methylpyrazol-3-yl)carbonylamino]benzoate::methyl 2-[(2-methylpyrazole-3-carbonyl)amino]benzoate::methyl 2-{[(1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate

SMILES: COC(=O)c1ccccc1NC(=O)c1ccnn1C

InChI Key: InChIKey=MKVVJWRRLDTYJC-UHFFFAOYSA-N

Data: 2 IC50

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

Found 2 hits for monomerid = 114880   
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
Nuclear hormone receptor family member daf-12


(Caenorhabditis elegans)
BDBM114880
PNG
(2-[(2-methylpyrazole-3-carbonyl)amino]benzoic acid...)
Show SMILES COC(=O)c1ccccc1NC(=O)c1ccnn1C
Show InChI InChI=1S/C13H13N3O3/c1-16-11(7-8-14-16)12(17)15-10-6-4-3-5-9(10)13(18)19-2/h3-8H,1-2H3,(H,15,17)
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.75E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: UT Southwestern Assay Provider: David Mangelsdorf,...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2736PK0
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))
BDBM114880
PNG
(2-[(2-methylpyrazole-3-carbonyl)amino]benzoic acid...)
Show SMILES COC(=O)c1ccccc1NC(=O)c1ccnn1C
Show InChI InChI=1S/C13H13N3O3/c1-16-11(7-8-14-16)12(17)15-10-6-4-3-5-9(10)13(18)19-2/h3-8H,1-2H3,(H,15,17)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.75E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: UT Southwestern Assay Provider: David Mangelsdorf,...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2TX3D2C
More data for this
Ligand-Target Pair