Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Histamine H3 receptor' and Ligand = 'BDBM50129254'   

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))	BDBM50129254 (CHEMBL303824 | [2-(1-Methyl-pyrrolidin-2-yl)-ethyl...) Show SMILES CN1CCCC1CCNc1c2CCCCCc2nc2ccccc12 Show InChI InChI=1S/C21H29N3/c1-24-15-7-8-16(24)13-14-22-21-17-9-3-2-4-11-19(17)23-20-12-6-5-10-18(20)21/h5-6,10,12,16H,2-4,7-9,11,13-15H2,1H3,(H,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	18	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 towards rat cortical Histamine H3 receptor				Bioorg Med Chem Lett 13: 2131-5 (2003) BindingDB Entry DOI: 10.7270/Q2K073N9
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50129254 (CHEMBL303824 | [2-(1-Methyl-pyrrolidin-2-yl)-ethyl...) Show SMILES CN1CCCC1CCNc1c2CCCCCc2nc2ccccc12 Show InChI InChI=1S/C21H29N3/c1-24-15-7-8-16(24)13-14-22-21-17-9-3-2-4-11-19(17)23-20-12-6-5-10-18(20)21/h5-6,10,12,16H,2-4,7-9,11,13-15H2,1H3,(H,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards human H3L receptor				Bioorg Med Chem Lett 13: 2131-5 (2003) BindingDB Entry DOI: 10.7270/Q2K073N9
					More data for this Ligand-Target Pair
Histamine H3 receptor (Homo sapiens (Human))	BDBM50129254 (CHEMBL303824 | [2-(1-Methyl-pyrrolidin-2-yl)-ethyl...) Show SMILES CN1CCCC1CCNc1c2CCCCCc2nc2ccccc12 Show InChI InChI=1S/C21H29N3/c1-24-15-7-8-16(24)13-14-22-21-17-9-3-2-4-11-19(17)23-20-12-6-5-10-18(20)21/h5-6,10,12,16H,2-4,7-9,11,13-15H2,1H3,(H,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Compound was tested for its binding affinity towards human H3L receptor				Bioorg Med Chem Lett 13: 2131-5 (2003) BindingDB Entry DOI: 10.7270/Q2K073N9
					More data for this Ligand-Target Pair