Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1B' and Ligand = 'BDBM50203576'   

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 1B (Homo sapiens (Human))	BDBM50203576 (1-(6-((5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl)met...) Show SMILES CC1CC(CC1C)N1CCN(CC1)C1CCc2ccc(OCc3noc(n3)-c3ccc(Cl)cc3)cc12 |w:13.14,3.7,1.0,5.6| Show InChI InChI=1S/C29H35ClN4O2/c1-19-15-24(16-20(19)2)33-11-13-34(14-12-33)27-10-6-21-5-9-25(17-26(21)27)35-18-28-31-29(36-32-28)22-3-7-23(30)8-4-22/h3-5,7-9,17,19-20,24,27H,6,10-16,18H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	414	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Displacement of [3H]5-hydroxytrytamine from human 5HT1B receptor expressed in HEK293 cells				Bioorg Med Chem Lett 17: 1675-8 (2007) Article DOI: 10.1016/j.bmcl.2006.12.109 BindingDB Entry DOI: 10.7270/Q25H7FXG
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