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BDBM50300226 3-(3-Chlorobenzyl)-5-isobutyl-5-methyl-2-iminohydantoin::CHEMBL566306

SMILES: CC(C)CC1(C)N=C(N)N(Cc2cccc(Cl)c2)C1=O

InChI Key: InChIKey=SMHLWQCDIJPLEC-UHFFFAOYNA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50300226   
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))
BDBM50300226
PNG
(3-(3-Chlorobenzyl)-5-isobutyl-5-methyl-2-iminohyda...)
Show SMILES CC(C)CC1(C)N=C(N)N(Cc2cccc(Cl)c2)C1=O
Show InChI InChI=1/C15H20ClN3O/c1-10(2)8-15(3)13(20)19(14(17)18-15)9-11-5-4-6-12(16)7-11/h4-7,10H,8-9H2,1-3H3,(H2,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/a 123n/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibition of BACE1 by fragment-based NMR screening method


J Med Chem 53: 951-65 (2010)


Article DOI: 10.1021/jm901408p
BindingDB Entry DOI: 10.7270/Q26W9B4S
More data for this
Ligand-Target Pair