BDBM50177796 CHEMBL3814103

SMILES: Cc1cccc(CNc2nc(N)c3ccccc3n2)c1

InChI Key: InChIKey=YRMDSZIDGQJOIX-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 = 50177796   

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
Amyloid-beta precursor protein (Homo sapiens (Human))	BDBM50177796 (CHEMBL3814103) Show SMILES Cc1cccc(CNc2nc(N)c3ccccc3n2)c1 Show InChI InChI=1S/C16H16N4/c1-11-5-4-6-12(9-11)10-18-16-19-14-8-3-2-7-13(14)15(17)20-16/h2-9H,10H2,1H3,(H3,17,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Waterloo Curated by ChEMBL					Assay Description Inhibition of self-induced amyloid beta 40 (unknown origin) aggregation measured for 24 hrs by thioflavin T-based fluorescence spectroscopic analysis				ACS Med Chem Lett 7: 502-7 (2016) BindingDB Entry DOI: 10.7270/Q27W6F3R
					More data for this Ligand-Target Pair
Amyloid-beta precursor protein (Homo sapiens (Human))	BDBM50177796 (CHEMBL3814103) Show SMILES Cc1cccc(CNc2nc(N)c3ccccc3n2)c1 Show InChI InChI=1S/C16H16N4/c1-11-5-4-6-12(9-11)10-18-16-19-14-8-3-2-7-13(14)15(17)20-16/h2-9H,10H2,1H3,(H3,17,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Waterloo Curated by ChEMBL					Assay Description Inhibition of self-induced amyloid beta 42 (unknown origin) aggregation measured for 24 hrs by thioflavin T-based fluorescence spectroscopic analysis				ACS Med Chem Lett 7: 502-7 (2016) BindingDB Entry DOI: 10.7270/Q27W6F3R
					More data for this Ligand-Target Pair