Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H1 receptor' and Ligand = 'BDBM50397497'   

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))	BDBM50397497 (CHEMBL2171044) Show SMILES Clc1ccc(OC2CCN(CC2)C2CCN(CC2)C(=O)NS(=O)(=O)c2cccc(c2)C#N)cc1Cl Show InChI InChI=1S/C24H26Cl2N4O4S/c25-22-5-4-20(15-23(22)26)34-19-8-12-29(13-9-19)18-6-10-30(11-7-18)24(31)28-35(32,33)21-3-1-2-17(14-21)16-27/h1-5,14-15,18-19H,6-13H2,(H,28,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	19.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [3H]pyrilamine from human H1 receptor expressed in CHOK1 cells				Bioorg Med Chem Lett 22: 6688-93 (2012) Article DOI: 10.1016/j.bmcl.2012.08.124 BindingDB Entry DOI: 10.7270/Q2QF8V00
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