Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2A' and Ligand = 'BDBM50321867'   

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))	BDBM50321867 (6-Iodo-5-methyl-2,3-dihydro-indole-1-carboxylic ac...) Show SMILES Cc1cc2CCN(C(=O)Nc3cccnc3)c2cc1I Show InChI InChI=1S/C15H14IN3O/c1-10-7-11-4-6-19(14(11)8-13(10)16)15(20)18-12-3-2-5-17-9-12/h2-3,5,7-9H,4,6H2,1H3,(H,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity towards human 5-hydroxytryptamine 2A receptor expressed in HEK 293 cells using [3H]ketanserin as radioligand				J Med Chem 41: 1598-612 (1998) Article DOI: 10.1021/jm970741j BindingDB Entry DOI: 10.7270/Q2WM1H48
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50321867 (6-Iodo-5-methyl-2,3-dihydro-indole-1-carboxylic ac...) Show SMILES Cc1cc2CCN(C(=O)Nc3cccnc3)c2cc1I Show InChI InChI=1S/C15H14IN3O/c1-10-7-11-4-6-19(14(11)8-13(10)16)15(20)18-12-3-2-5-17-9-12/h2-3,5,7-9H,4,6H2,1H3,(H,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of North Texas Health Science Center Curated by ChEMBL					Assay Description Displacement of [3H]methylspiperone from human cloned 5HT2A receptor expressed in HEK293 cells after 90 mins by liquid scintillation counting				Bioorg Med Chem 18: 4783-92 (2011) Article DOI: 10.1016/j.bmc.2010.05.017 BindingDB Entry DOI: 10.7270/Q2V69KJ2
					More data for this Ligand-Target Pair