BindingDB logo
myBDB logout

BDBM301741 2-(3,5-Difluoro-4-(3-(methylsulfonyl)propoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane::US9597310, 31

SMILES: CC(C)(O)Cn1cc(cn1)-c1cc(F)c(Oc2ccc(F)c3[C@@H](CCc23)Oc2ccc3[C@H](CC(O)=O)COc3c2)c(F)c1

InChI Key: InChIKey=MXOUZSGTOSXDFG-DNOBIOAJSA-N

Data: 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 1 hit for monomerid = 301741   
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
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM301741
PNG
(2-(3,5-Difluoro-4-(3-(methylsulfonyl)propoxy)pheny...)
Show SMILES CC(C)(O)Cn1cc(cn1)-c1cc(F)c(Oc2ccc(F)c3[C@@H](CCc23)Oc2ccc3[C@H](CC(O)=O)COc3c2)c(F)c1 |r|
Show InChI InChI=1S/C32H29F3N2O6/c1-32(2,40)16-37-14-19(13-36-37)17-9-24(34)31(25(35)10-17)43-26-8-6-23(33)30-22(26)5-7-27(30)42-20-3-4-21-18(11-29(38)39)15-41-28(21)12-20/h3-4,6,8-10,12-14,18,27,40H,5,7,11,15-16H2,1-2H3,(H,38,39)/t18-,27-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 58n/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
IP1 accumulation measurements using the IPOne assay system 1321N1 cells stably expressing human GPR40 receptor (Euroscreen, Belgium) are seeded 24 h ...

US Patent US9597310 (2017)


BindingDB Entry DOI: 10.7270/Q2RX9F3W
More data for this
Ligand-Target Pair