Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H3 receptor' and Ligand = 'BDBM50119726'   

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 (Rattus norvegicus (rat))	BDBM50119726 ((1-{(S)-1-[3-(4-Acetyl-phenoxy)-propyl]-pyrrolidin...) Show SMILES C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(C)=O)C1 Show InChI InChI=1S/C23H35N3O5/c1-16(24-22(29)31-23(3,4)5)21(28)25-19-11-13-26(15-19)12-6-14-30-20-9-7-18(8-10-20)17(2)27/h7-10,16,19H,6,11-15H2,1-5H3,(H,24,29)(H,25,28)/t16-,19+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	307	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity against rat histamine H3 receptor				Bioorg Med Chem Lett 12: 3055-8 (2002) BindingDB Entry DOI: 10.7270/Q2B56J3P
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