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SMILES: C\C(CN1CCCC1)=C1/C[C@](C)(N=C(N)S1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F

InChI Key: InChIKey=ASVKJLBLFIQRDJ-YVVITCHPSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 210123   
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
Beta-secretase 1


(Homo sapiens (Human))		BDBM210123
PNG
(US9270353, 98)
Show SMILES C\C(CN1CCCC1)=C1/C[C@](C)(N=C(N)S1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F |r,t:13|
Show InChI InChI=1S/C25H27FN6OS/c1-16(15-32-9-3-4-10-32)22-12-25(2,31-24(28)34-22)19-11-18(6-7-20(19)26)30-23(33)21-8-5-17(13-27)14-29-21/h5-8,11,14H,3-4,9-10,12,15H2,1-2H3,(H2,28,31)(H,30,33)/b22-16-/t25-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+3n/an/an/an/a5.0n/a



Shionogi & Co., Ltd.

US Patent


Assay Description
48.5 μL of substrate peptide solution (Biotin-XSEVNLDAEFRHDSGC-Eu: X=ε-amino-n-capronic acid, Eu=Europium cryptate) was added to each well ...

US Patent US9273053 (2016)


BindingDB Entry DOI: 10.7270/Q24Q7SVG
More data for this
Ligand-Target Pair