BDBM234478 US10004738, 31::US9353084, 31

SMILES: C[C@@]1(F)CC(F)(F)[C@](C)(N=C1N)c1cc(NC(=O)c2nc(CF)cs2)ccc1F

InChI Key: InChIKey=NSOJAQHWGSHYBF-IAGOWNOFSA-N

Data: 2 KI

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 2 hits for monomerid = 234478   

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 (Homo sapiens (Human))	BDBM234478 (US10004738, 31 | US9353084, 31) Show SMILES C[C@@]1(F)CC(F)(F)[C@](C)(N=C1N)c1cc(NC(=O)c2nc(CF)cs2)ccc1F |r,c:9| Show InChI InChI=1S/C18H17F5N4OS/c1-16(21)8-18(22,23)17(2,27-15(16)24)11-5-9(3-4-12(11)20)25-13(28)14-26-10(6-19)7-29-14/h3-5,7H,6,8H2,1-2H3,(H2,24,27)(H,25,28)/t16-,17-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	92	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/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))	BDBM234478 (US10004738, 31 | US9353084, 31) Show SMILES C[C@@]1(F)CC(F)(F)[C@](C)(N=C1N)c1cc(NC(=O)c2nc(CF)cs2)ccc1F |r,c:9| Show InChI InChI=1S/C18H17F5N4OS/c1-16(21)8-18(22,23)17(2,27-15(16)24)11-5-9(3-4-12(11)20)25-13(28)14-26-10(6-19)7-29-14/h3-5,7H,6,8H2,1-2H3,(H2,24,27)(H,25,28)/t16-,17-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	92	n/a	n/a	n/a	n/a	n/a	n/a	4.5	n/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