Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 330.4 BDBM50064205

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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
Beta-2 adrenergic receptor (Canis familiaris)	BDBM50064205 (CHEMBL42117 | Dicyclopropyl-methanone O-[3-(4-tert...) Show SMILES CC(C)(C)c1ccc(NCC(O)CON=C(C2CC2)C2CC2)cc1 Show InChI InChI=1S/C20H30N2O2/c1-20(2,3)16-8-10-17(11-9-16)21-12-18(23)13-24-22-19(14-4-5-14)15-6-7-15/h8-11,14-15,18,21,23H,4-7,12-13H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Grenoble Curated by ChEMBL					Assay Description Inhibition of beta-2 adrenergic receptor isolated from rat lung homogenates				J Med Chem 41: 1613-8 (1998) Article DOI: 10.1021/jm970338c BindingDB Entry DOI: 10.7270/Q2416W5G
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