BDBM38211 US8546380, 698::US8633188, 698

SMILES: CC1(CCSC(N)=N1)c1cc(Cl)cc(NC(=O)c2ccc(Br)cc2)c1

InChI Key: InChIKey=RRGAZBYPOBROOI-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 38211   

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))	BDBM38211 (US8546380, 698 | US8633188, 698) Show SMILES CC1(CCSC(N)=N1)c1cc(Cl)cc(NC(=O)c2ccc(Br)cc2)c1 |c:6| Show InChI InChI=1S/C18H17BrClN3OS/c1-18(6-7-25-17(21)23-18)12-8-14(20)10-15(9-12)22-16(24)11-2-4-13(19)5-3-11/h2-5,8-10H,6-7H2,1H3,(H2,21,23)(H,22,24)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	165	n/a	n/a	n/a	n/a	5.0	30
Shionogi & Co., Ltd. US Patent					Assay Description Zero point five μL of the test compounds (dissolved in N,N′-dimethylsulfoxide) were incubated with 48.5 μL of the fluorescence-quench...				US Patent US8633188 (2014) BindingDB Entry DOI: 10.7270/Q2FT8JQ0
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM38211 (US8546380, 698 | US8633188, 698) Show SMILES CC1(CCSC(N)=N1)c1cc(Cl)cc(NC(=O)c2ccc(Br)cc2)c1 |c:6| Show InChI InChI=1S/C18H17BrClN3OS/c1-18(6-7-25-17(21)23-18)12-8-14(20)10-15(9-12)22-16(24)11-2-4-13(19)5-3-11/h2-5,8-10H,6-7H2,1H3,(H2,21,23)(H,22,24)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	165	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi & Co., Ltd. US Patent					Assay Description Inhibition assay using beta-Secretase activity.				US Patent US8546380 (2013) BindingDB Entry DOI: 10.7270/Q2HQ3XJ0
					More data for this Ligand-Target Pair