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BDBM147473 US8957219, II-2-291

SMILES: FC(F)(F)Oc1ccc(cc1)-c1ccc2sc(CC(=O)NCC(=O)NCC#N)nc2c1

InChI Key: InChIKey=XNLSVMJUASDSLB-UHFFFAOYSA-N

Data: 1 IC50

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 = 147473   
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
Endothelial lipase


(Homo sapiens (Human))
BDBM147473
PNG
(US8957219, II-2-291)
Show SMILES FC(F)(F)Oc1ccc(cc1)-c1ccc2sc(CC(=O)NCC(=O)NCC#N)nc2c1
Show InChI InChI=1S/C20H15F3N4O3S/c21-20(22,23)30-14-4-1-12(2-5-14)13-3-6-16-15(9-13)27-19(31-16)10-17(28)26-11-18(29)25-8-7-24/h1-6,9H,8,10-11H2,(H,25,29)(H,26,28)
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 56n/an/an/an/an/a37



Shionogi & Co., Ltd

US Patent


Assay Description
After the present compound dissolved in DMSO was added to become 0.5% DMSO to the reaction buffer consisting of 20 mM tris hydrochloric acid (pH7.4),...


US Patent US8957219 (2015)


BindingDB Entry DOI: 10.7270/Q2NS0SM1
More data for this
Ligand-Target Pair