Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Alpha-1A adrenergic receptor' and Ligand = 'BDBM50103887'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50103887 (CHEMBL3343977) Show SMILES Cc1ccc2c(NCCNc3ccnc4cc(C)ccc34)ccnc2c1 Show InChI InChI=1S/C22H22N4/c1-15-3-5-17-19(7-9-23-21(17)13-15)25-11-12-26-20-8-10-24-22-14-16(2)4-6-18(20)22/h3-10,13-14H,11-12H2,1-2H3,(H,23,25)(H,24,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
25288493 Curated by ChEMBL					Assay Description Binding affinity to human alpha1A adrenergic receptor transfected in COS1 cells assessed as compound required to occupy 50% of receptor				Bioorg Med Chem 22: 5910-6 (2014) Article DOI: 10.1016/j.bmc.2014.09.017 BindingDB Entry DOI: 10.7270/Q2NS0WP5
					More data for this Ligand-Target Pair
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50103887 (CHEMBL3343977) Show SMILES Cc1ccc2c(NCCNc3ccnc4cc(C)ccc34)ccnc2c1 Show InChI InChI=1S/C22H22N4/c1-15-3-5-17-19(7-9-23-21(17)13-15)25-11-12-26-20-8-10-24-22-14-16(2)4-6-18(20)22/h3-10,13-14H,11-12H2,1-2H3,(H,23,25)(H,24,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
25288493 Curated by ChEMBL					Assay Description Displacement of [3H]-prazosin from human alpha1A adrenergic receptor transfected in COS1 cells				Bioorg Med Chem 22: 5910-6 (2014) Article DOI: 10.1016/j.bmc.2014.09.017 BindingDB Entry DOI: 10.7270/Q2NS0WP5
					More data for this Ligand-Target Pair