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BDBM50391820 CHEMBL2146908

SMILES: OC(=O)c1cc(O)cc(c1)C#N

InChI Key: InChIKey=AIJZBNIPPCUFCO-UHFFFAOYSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50391820   
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 1


(Homo sapiens (Human))
BDBM50391820
PNG
(CHEMBL2146908)
Show SMILES OC(=O)c1cc(O)cc(c1)C#N
Show InChI InChI=1S/C8H5NO3/c9-4-5-1-6(8(11)12)3-7(10)2-5/h1-3,10H,(H,11,12)
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KEGG

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UniProtKB/TrEMBL

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CHEMBL
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+6n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant GPR81 transfected in african green monkey COS-7 cells after 20 mins by [35S]GTPgammaS binding assay


ACS Med Chem Lett 3: 637-639 (2012)


Article DOI: 10.1021/ml3000676
BindingDB Entry DOI: 10.7270/Q27945RB
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50391820
PNG
(CHEMBL2146908)
Show SMILES OC(=O)c1cc(O)cc(c1)C#N
Show InChI InChI=1S/C8H5NO3/c9-4-5-1-6(8(11)12)3-7(10)2-5/h1-3,10H,(H,11,12)
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+6n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant GPR109a transfected in african green monkey COS-7 cells after 20 mins by [35S]GTPgammaS binding assay


ACS Med Chem Lett 3: 637-639 (2012)


Article DOI: 10.1021/ml3000676
BindingDB Entry DOI: 10.7270/Q27945RB
More data for this
Ligand-Target Pair