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BDBM400607 US9999624, 6

SMILES: NC1=N[C@]2(CN(C[C@H]2CS1)c1ncc(F)cn1)c1cccc(NC(=O)c2ccc(cn2)C#N)c1

InChI Key: InChIKey=YTAZIODAUBSVFU-QMHKHESXSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 400607   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Beta-secretase 1


(Homo sapiens (Human))
BDBM400607
PNG
(US9999624, 6)
Show SMILES NC1=N[C@]2(CN(C[C@H]2CS1)c1ncc(F)cn1)c1cccc(NC(=O)c2ccc(cn2)C#N)c1
Show InChI InChI=1S/C23H19FN8OS/c24-17-9-28-22(29-10-17)32-11-16-12-34-21(26)31-23(16,13-32)15-2-1-3-18(6-15)30-20(33)19-5-4-14(7-25)8-27-19/h1-6,8-10,16H,11-13H2,(H2,26,31)(H,30,33)/t16-,23+/m0/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 0.450n/an/an/an/an/an/a



Eli Lilly and Company

US Patent


Assay Description
Serial dilutions of test compounds are prepared as described above. Compounds are further diluted 20 in KH2PO4 buffer. Ten μL of each dilution ...


US Patent US9999624 (2018)


BindingDB Entry DOI: 10.7270/Q27H1MZB
More data for this
Ligand-Target Pair