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SMILES: Oc1ccc(\C=C\C(=O)CC(=O)\C=C\c2cc(OCc3ccccc3)ccc2Br)cc1

InChI Key: InChIKey=RDZGFQBKIIWYEF-QHKWOANTSA-N

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   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 = 149318   
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))		BDBM149318
PNG
(US8962674, CU531)
Show SMILES Oc1ccc(\C=C\C(=O)CC(=O)\C=C\c2cc(OCc3ccccc3)ccc2Br)cc1
Show InChI InChI=1S/C26H21BrO4/c27-26-15-14-25(31-18-20-4-2-1-3-5-20)16-21(26)9-13-24(30)17-23(29)12-8-19-6-10-22(28)11-7-19/h1-16,28H,17-18H2/b12-8+,13-9+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 370n/an/an/an/a4.537



Tokyo Institute of Technology; Kyoto University

US Patent


Assay Description
Compounds were dissolved in dimethylsulfoxide (DMSO), and further diluted in 0.1 M sodium acetate buffer (with 150 mM sodium chloride, pH 4.5). The s...

US Patent US8962674 (2015)


BindingDB Entry DOI: 10.7270/Q2QJ7G1J
More data for this
Ligand-Target Pair