Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H1 receptor' and Ligand = 'BDBM50061467'   

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 (RAT)	BDBM50061467 (1-[4-(8-Chloro-3-hydroxymethyl-5,6-dihydro-benzo[5...) Show SMILES [#6]-[#6](=O)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1/c2ccc(Cl)cc2-[#6]-[#6]-c2cc(-[#6]-[#8])cnc-12 Show InChI InChI=1S/C22H23ClN2O2/c1-14(27)25-8-6-16(7-9-25)21-20-5-4-19(23)11-17(20)2-3-18-10-15(13-26)12-24-22(18)21/h4-5,10-12,26H,2-3,6-9,13H2,1H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to displace [3H]-pyrilamine from H1 receptor in rat brain membrane.				Bioorg Med Chem Lett 3: 1073-1078 (1993) Article DOI: 10.1016/S0960-894X(00)80290-5 BindingDB Entry DOI: 10.7270/Q2445MDZ
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