BDBM50314609 3'-(2-amino-1-methyl-5-oxo-4-(pyridin-4-yl)-4,5-dihydro-1H-imidazol-4-yl)biphenyl-3-carbonitrile::CHEMBL1092475

SMILES: CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccc(c1)C#N

InChI Key: InChIKey=MADLMWLQBKXXTR-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50314609   

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))	BDBM50314609 (3'-(2-amino-1-methyl-5-oxo-4-(pyridin-4-yl)-4,5-di...) Show SMILES CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccc(c1)C#N |c:3| Show InChI InChI=1S/C22H17N5O/c1-27-20(28)22(26-21(27)24,18-8-10-25-11-9-18)19-7-3-6-17(13-19)16-5-2-4-15(12-16)14-23/h2-13H,1H3,(H2,24,26)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of BACE1 by FRET assay				Bioorg Med Chem Lett 20: 2326-9 (2010) Article DOI: 10.1016/j.bmcl.2010.01.136 BindingDB Entry DOI: 10.7270/Q28C9WDF
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50314609 (3'-(2-amino-1-methyl-5-oxo-4-(pyridin-4-yl)-4,5-di...) Show SMILES CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccc(c1)C#N |c:3| Show InChI InChI=1S/C22H17N5O/c1-27-20(28)22(26-21(27)24,18-8-10-25-11-9-18)19-7-3-6-17(13-19)16-5-2-4-15(12-16)14-23/h2-13H,1H3,(H2,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of cathepsin D by FRET assay				Bioorg Med Chem Lett 20: 2326-9 (2010) Article DOI: 10.1016/j.bmcl.2010.01.136 BindingDB Entry DOI: 10.7270/Q28C9WDF
					More data for this Ligand-Target Pair
Beta-secretase 2 (Homo sapiens (Human))	BDBM50314609 (3'-(2-amino-1-methyl-5-oxo-4-(pyridin-4-yl)-4,5-di...) Show SMILES CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccc(c1)C#N |c:3| Show InChI InChI=1S/C22H17N5O/c1-27-20(28)22(26-21(27)24,18-8-10-25-11-9-18)19-7-3-6-17(13-19)16-5-2-4-15(12-16)14-23/h2-13H,1H3,(H2,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of BACE2 by FRET assay				Bioorg Med Chem Lett 20: 2326-9 (2010) Article DOI: 10.1016/j.bmcl.2010.01.136 BindingDB Entry DOI: 10.7270/Q28C9WDF
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM50314609 (3'-(2-amino-1-methyl-5-oxo-4-(pyridin-4-yl)-4,5-di...) Show SMILES CN1C(N)=NC(C1=O)(c1ccncc1)c1cccc(c1)-c1cccc(c1)C#N |c:3| Show InChI InChI=1S/C22H17N5O/c1-27-20(28)22(26-21(27)24,18-8-10-25-11-9-18)19-7-3-6-17(13-19)16-5-2-4-15(12-16)14-23/h2-13H,1H3,(H2,24,26)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of human BACE1				Eur J Med Chem 46: 58-64 (2010) Article DOI: 10.1016/j.ejmech.2010.10.014 BindingDB Entry DOI: 10.7270/Q2P55PRK
					More data for this Ligand-Target Pair