Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H1 receptor' and Ligand = 'BDBM50417361'   

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 H1 receptor (Homo sapiens (Human))	BDBM50417361 (CHEMBL1277035) Show SMILES [#8]-[#6](=O)\[#6]=[#6]-1/[#6]-[#7](-[#6]-1)-[#6]-1-[#6]-[#6]C2([#6]-1)[#6]-c1ccccc1-[#6]-c1ccccc21 Show InChI InChI=1S/C24H25NO2/c26-23(27)11-17-15-25(16-17)21-9-10-24(14-21)13-20-7-2-1-5-18(20)12-19-6-3-4-8-22(19)24/h1-8,11,21H,9-10,12-16H2,(H,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity against human histamine H1 receptor expressed in CHO cells by FLIPR assay				J Med Chem 53: 7778-95 (2010) Article DOI: 10.1021/jm100856p BindingDB Entry DOI: 10.7270/Q2FQ9WWQ
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