Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2B' and Ligand = 'BDBM50148838'   

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
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50148838 (CHEMBL3770512) Show SMILES CCCOC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 |c:15,t:12| Show InChI InChI=1S/C18H25N5O2/c1-2-11-25-15(24)13-7-6-8-14(12-13)20-17-21-16(19)22-18(23-17)9-4-3-5-10-18/h6-8,12H,2-5,9-11H2,1H3,(H4,19,20,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Biological Sciences, Beijing Curated by ChEMBL					Assay Description Antagonist activity at 5-HT2B receptor (unknown origin) expressed in CHO-K1 cells assessed as calcium flux after 60 mins by FLIPR assay				J Med Chem 59: 707-20 (2016) Article DOI: 10.1021/acs.jmedchem.5b01631 BindingDB Entry DOI: 10.7270/Q2D50PT3
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