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BDBM234467 US10004738, 20::US9353084, 20

SMILES: Cc1nnc(o1)C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@](C)(F)CC1(F)F

InChI Key: InChIKey=ZXEUQJAXUTWMOI-JKSUJKDBSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 234467   
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))
BDBM234467
PNG
(US10004738, 20 | US9353084, 20)
Show SMILES Cc1nnc(o1)C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@](C)(F)CC1(F)F |r,t:20|
Show InChI InChI=1S/C17H17F4N5O2/c1-8-25-26-13(28-8)12(27)23-9-4-5-11(18)10(6-9)16(3)17(20,21)7-15(2,19)14(22)24-16/h4-6H,7H2,1-3H3,(H2,22,24)(H,23,27)/t15-,16+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
1.60E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The binding assay was performed as SPA-based assay using a biotinylated form of human BACE1 recombinantly expressed and subsequently purified from Fr...


J Med Chem 52: 6621-36 (2009)


BindingDB Entry DOI: 10.7270/Q2B85BGS
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM234467
PNG
(US10004738, 20 | US9353084, 20)
Show SMILES Cc1nnc(o1)C(=O)Nc1ccc(F)c(c1)[C@@]1(C)N=C(N)[C@@](C)(F)CC1(F)F |r,t:20|
Show InChI InChI=1S/C17H17F4N5O2/c1-8-25-26-13(28-8)12(27)23-9-4-5-11(18)10(6-9)16(3)17(20,21)7-15(2,19)14(22)24-16/h4-6H,7H2,1-3H3,(H2,22,24)(H,23,27)/t15-,16+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
1.60E+3n/an/an/an/an/an/a4.5n/a



H. Lundbeck A/S

US Patent


Assay Description
The binding assay was performed as SPA-based assay using a biotinylated form of human BACE1 recombinantly expressed and subsequently purified from Fr...


US Patent US9353084 (2016)


BindingDB Entry DOI: 10.7270/Q2MG7NDX
More data for this
Ligand-Target Pair