BDBM307707 4''-fluoro-6'-(3-fluoropropoxy)-4-[(2H3)methyloxy]-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-pyrrol]-5''-amine::US9650336, Example 10

SMILES: COC1CC[C@]2(Cc3ccc(OCCCF)cc3C22C=C(F)C(N)=N2)CC1

InChI Key: InChIKey=CDBDNOAMUOHDPM-SDLRAYFESA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 307707   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Beta-secretase 1 (aa 1-460) (Homo sapiens (Human))	BDBM307707 (4''-fluoro-6'-(3-fluoropropoxy)-4-[(2H3)methyloxy]...) Show SMILES COC1CC[C@]2(Cc3ccc(OCCCF)cc3C22C=C(F)C(N)=N2)CC1 |r,wD:5.5,c:25,t:21,(7.88,-2.47,;7.11,-1.14,;5.57,-1.14,;4.8,-2.47,;3.26,-2.47,;2.49,-1.14,;1.59,-2.39,;.12,-1.91,;-1.21,-2.68,;-2.55,-1.91,;-2.55,-.37,;-3.88,.4,;-5.21,-.37,;-6.55,.4,;-7.88,-.37,;-9.21,.4,;-1.21,.4,;.12,-.37,;1.59,.1,;2.83,1.01,;2.36,2.47,;3.13,3.81,;.82,2.47,;.05,3.81,;.34,1.01,;3.26,.19,;4.8,.19,)| Show InChI InChI=1S/C21H26F2N2O2/c1-26-15-5-7-20(8-6-15)12-14-3-4-16(27-10-2-9-22)11-17(14)21(20)13-18(23)19(24)25-21/h3-4,11,13,15H,2,5-10,12H2,1H3,(H2,24,25)/t15?,20-,21?	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent					Assay Description The cDNA for the soluble part of the human 13-Secretase (AA 1-AA 460) was cloned using the ASP2-Fc10-1-IRES-GFP-neoK mammalian expression vector. The...				US Patent US9650336 (2017) BindingDB Entry DOI: 10.7270/Q23X88QM
					More data for this Ligand-Target Pair