Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor' and Ligand = 'BDBM50218780'   

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/Alpha-1B/Alpha-1D adrenergic receptor (Homo sapiens (Human))	BDBM50218780 (CHEMBL302292) Show SMILES OC(CN1CCC(O)(Cc2ccc(Br)cc2)CC1)Cc1ccc(O)cc1 Show InChI InChI=1S/C21H26BrNO3/c22-18-5-1-17(2-6-18)14-21(26)9-11-23(12-10-21)15-20(25)13-16-3-7-19(24)8-4-16/h1-8,20,24-26H,9-15H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	2.44E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd. Curated by ChEMBL					Assay Description In vitro binding affinity towards Alpha-1 adrenergic receptor by displacing [3H]prazosin radioligand				Bioorg Med Chem Lett 11: 2173-6 (2001) BindingDB Entry DOI: 10.7270/Q2GF0SS8
					More data for this Ligand-Target Pair