Reaction Details Report a problem with these data
Target
Free fatty acid receptor 1
Ligand
BDBM50158580
Substrate
n/a
Meas. Tech.
ChEMBL_1563448 (CHEMBL3783041)
EC50
61±n/a nM
Citation
 Li, Z; Pan, M; Su, X; Dai, Y; Fu, M; Cai, X; Shi, W; Huang, W; Qian, H Discovery of novel pyrrole-based scaffold as potent and orally bioavailable free fatty acid receptor 1 agonists for the treatment of type 2 diabetes. Bioorg Med Chem 24:1981-7 (2016) [PubMed]  Article 
Target
Name:
Free fatty acid receptor 1
Synonyms:
FFAR1 | FFAR1_HUMAN | G-protein Coupled Receptor 40 | GPR40
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
31473.32
Organism:
Homo sapiens (Human)
Description:
O14842
Residue:
300
Sequence:
MDLPPQLSFGLYVAAFALGFPLNVLAIRGATAHARLRLTPSLVYALNLGCSDLLLTVSLPLKAVEALASGAWPLPASLCPVFAVAHFFPLYAGGGFLAALSAGRYLGAAFPLGYQAFRRPCYSWGVCAAIWALVLCHLGLVFGLEAPGGWLDHSNTSLGINTPVNGSPVCLEAWDPASAGPARFSLSLLLFFLPLAITAFCYVGCLRALARSGLTHRRKLRAAWVAGGALLTLLLCVGPYNASNVASFLYPNLGGSWRKLGLITGAWSVVLNPLVTGYLGRGPGLKTVCAARTQGGKSQK
  
Inhibitor
Name:
BDBM50158580
Synonyms:
CHEMBL3781733
Type:
Small organic molecule
Emp. Form.:
C25H27NO5
Mol. Mass.:
421.4856
SMILES:
CCOc1ccc(COc2ccc3C(CC(O)=O)COc3c2)cc1-n1c(C)ccc1C |(-11.48,-5.94,;-10.41,-5.34,;-9.08,-6.12,;-7.74,-5.36,;-7.73,-3.82,;-6.39,-3.06,;-5.06,-3.84,;-3.72,-3.07,;-3.72,-1.53,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;2.24,2.7,;3.75,3.01,;4.57,2.1,;4.13,4.18,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-5.07,-5.38,;-6.41,-6.14,;-6.42,-7.68,;-7.67,-8.55,;-8.84,-8.15,;-7.21,-10.02,;-5.67,-10.03,;-5.18,-8.57,;-4.01,-8.19,)|
Structure:
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