Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-1A adrenergic receptor' and Ligand = 'BDBM50087484'   

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 (Rattus norvegicus (Rat))	BDBM50087484 (6-Chloro-2-[2-(6-methoxy-1,3,3a,4,5,9b-hexahydro-b...) Show SMILES COc1cccc2[C@@H]3CN(CCn4c(=O)[nH]c5c6nc(Cl)ccc6sc5c4=O)C[C@@H]3CCc12 Show InChI InChI=1S/C24H23ClN4O3S/c1-32-17-4-2-3-14-15(17)6-5-13-11-28(12-16(13)14)9-10-29-23(30)22-21(27-24(29)31)20-18(33-22)7-8-19(25)26-20/h2-4,7-8,13,16H,5-6,9-12H2,1H3,(H,27,31)/t13-,16+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity using [3H]-prazosin as radioligand against adrenoceptor alpha 1A				J Med Chem 43: 1586-603 (2000) BindingDB Entry DOI: 10.7270/Q29C6WNR
					More data for this Ligand-Target Pair