BDBM50246071 CHEMBL470311::N4-(3-chloro-4-methoxybenzyl)-8-allyl-7-methoxyquinazoline-4,6-diamine

SMILES: COc1ccc(CNc2ncnc3c(CC=C)c(OC)c(N)cc23)cc1Cl

InChI Key: InChIKey=KXWJPDDRBNEXAF-UHFFFAOYSA-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 = 50246071   

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
Phosphodiesterase 5A (Bos taurus)	BDBM50246071 (CHEMBL470311 | N4-(3-chloro-4-methoxybenzyl)-8-all...) Show SMILES COc1ccc(CNc2ncnc3c(CC=C)c(OC)c(N)cc23)cc1Cl Show InChI InChI=1S/C20H21ClN4O2/c1-4-5-13-18-14(9-16(22)19(13)27-3)20(25-11-24-18)23-10-12-6-7-17(26-2)15(21)8-12/h4,6-9,11H,1,5,10,22H2,2-3H3,(H,23,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chong Kun Dang Research Institute Curated by ChEMBL					Assay Description Inhibition of bovine PDE5				Bioorg Med Chem Lett 18: 6279-82 (2008) Article DOI: 10.1016/j.bmcl.2008.09.108 BindingDB Entry DOI: 10.7270/Q2SB45MV
					More data for this Ligand-Target Pair