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BDBM50022069 CHEMBL3299016

SMILES: OC(=O)C1=C(CCCC1)NC(=O)\C=C\c1cc2ccccc2nc1Cl

InChI Key: InChIKey=IGTQKGWKKCOSPJ-MDZDMXLPSA-N

Data: 1 EC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50022069   
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))
BDBM50022069
PNG
(CHEMBL3299016)
Show SMILES OC(=O)C1=C(CCCC1)NC(=O)\C=C\c1cc2ccccc2nc1Cl |t:3|
Show InChI InChI=1S/C19H17ClN2O3/c20-18-13(11-12-5-1-3-7-15(12)22-18)9-10-17(23)21-16-8-4-2-6-14(16)19(24)25/h1,3,5,7,9-11H,2,4,6,8H2,(H,21,23)(H,24,25)/b10-9+
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Similars

Article
PubMed
n/an/an/an/a 2.74E+4n/an/an/an/a



Latvian Institute of Organic Synthesis

Curated by ChEMBL


Assay Description
Agonist activity at human HCA2 receptor expressed in Flp-In-293 cells assessed as inhibition of forskolin-induced cAMP accumulation after 30 mins


Bioorg Med Chem 22: 3654-69 (2014)


Article DOI: 10.1016/j.bmc.2014.05.011
BindingDB Entry DOI: 10.7270/Q21J9CCB
More data for this
Ligand-Target Pair