Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2A' and Ligand = 'BDBM50354095'   

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 (Rattus norvegicus (rat))	BDBM50354095 (CHEMBL1836058) Show SMILES COc1cccc(c1)C(=O)NC1C[C@H]2CC[C@H](C1)N2CC1CCCO1 |r,TLB:10:11:18:14.15| Show InChI InChI=1S/C20H28N2O3/c1-24-18-5-2-4-14(10-18)20(23)21-15-11-16-7-8-17(12-15)22(16)13-19-6-3-9-25-19/h2,4-5,10,15-17,19H,3,6-9,11-13H2,1H3,(H,21,23)/t16-,17-,19?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from 5HT2A in rat brain cerebral cortex after 20 mins by scintillation counting				Eur J Med Chem 46: 4474-88 (2011) Article DOI: 10.1016/j.ejmech.2011.07.022 BindingDB Entry DOI: 10.7270/Q2Z0395D
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