Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H3 receptor' and Ligand = 'BDBM50181044'   

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
Histamine H3 receptor (Homo sapiens (Human))	BDBM50181044 (2-(3-(piperidin-1-yl)propyl)-2H-isoindole-1-carbon...) Show SMILES N#Cc1n(CCCN2CCCCC2)cc2ccccc12 Show InChI InChI=1S/C17H21N3/c18-13-17-16-8-3-2-7-15(16)14-20(17)12-6-11-19-9-4-1-5-10-19/h2-3,7-8,14H,1,4-6,9-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	351	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Displacement of [125I]iodoproxyfan from human histamine H3 receptor expressed in CHOK1 cells				Bioorg Med Chem Lett 16: 1938-40 (2006) Article DOI: 10.1016/j.bmcl.2005.12.084 BindingDB Entry DOI: 10.7270/Q237789Z
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