Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2A' and Ligand = 'BDBM50100389'   

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 2A (Homo sapiens (Human))	BDBM50100389 (CHEMBL3325905) Show SMILES CN1CCc2cc(NCc3cccc(Cl)c3)c(O)cc2C(C1)c1ccccc1 Show InChI InChI=1S/C24H25ClN2O/c1-27-11-10-19-13-23(26-15-17-6-5-9-20(25)12-17)24(28)14-21(19)22(16-27)18-7-3-2-4-8-18/h2-9,12-14,22,26,28H,10-11,15-16H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Institute of Materia Medica (SIMM) Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from human 5HT2A receptor expressed in HEK293 cell membranes by liquid scintillation counting based competition bindin...				Eur J Med Chem 85: 16-26 (2014) Article DOI: 10.1016/j.ejmech.2014.07.059 BindingDB Entry DOI: 10.7270/Q2PZ5BK4
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