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BDBM50342536 (R)-2-(2-amino-3-(3-(4-hydroxyphenyl)-1,2,4-oxadiazol-5-yl)propanamido)benzoic acid::CHEMBL1770176

SMILES: N[C@H](Cc1nc(no1)-c1ccc(O)cc1)C(=O)Nc1ccccc1C(O)=O

InChI Key: InChIKey=MLWGCXUMMIWGCW-CYBMUJFWSA-N

Data: 1 IC50  1 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 = 50342536   
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


(Homo sapiens (Human))
BDBM50342536
PNG
((R)-2-(2-amino-3-(3-(4-hydroxyphenyl)-1,2,4-oxadia...)
Show SMILES N[C@H](Cc1nc(no1)-c1ccc(O)cc1)C(=O)Nc1ccccc1C(O)=O |r|
Show InChI InChI=1S/C18H16N4O5/c19-13(17(24)20-14-4-2-1-3-12(14)18(25)26)9-15-21-16(22-27-15)10-5-7-11(23)8-6-10/h1-8,13,23H,9,19H2,(H,20,24)(H,25,26)/t13-/m1/s1
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KEGG

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 890n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant GPR109A receptor expressed in CHO-K1 cells after 60 mins by [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 21: 2721-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.116
BindingDB Entry DOI: 10.7270/Q2N29X8C
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50342536
PNG
((R)-2-(2-amino-3-(3-(4-hydroxyphenyl)-1,2,4-oxadia...)
Show SMILES N[C@H](Cc1nc(no1)-c1ccc(O)cc1)C(=O)Nc1ccccc1C(O)=O |r|
Show InChI InChI=1S/C18H16N4O5/c19-13(17(24)20-14-4-2-1-3-12(14)18(25)26)9-15-21-16(22-27-15)10-5-7-11(23)8-6-10/h1-8,13,23H,9,19H2,(H,20,24)(H,25,26)/t13-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 41n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]nicotinic acid from human GPR109A receptor


Bioorg Med Chem Lett 21: 2721-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.116
BindingDB Entry DOI: 10.7270/Q2N29X8C
More data for this
Ligand-Target Pair