Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2A' and Ligand = 'BDBM180710'   

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))	BDBM180710 (US8829029, 10) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC[C@H]2CC[C@@H](CC2)NC(=O)c2ccc(Cl)cc2)CC1 |r,wU:19.24,wD:16.17,(-4.3,-7.48,;-4.7,-5.99,;-3.61,-4.9,;-4.01,-3.41,;-5.5,-3.01,;-5.9,-1.53,;-7.38,-1.13,;-8.07,-3.7,;-6.59,-4.1,;-6.19,-5.59,;-4.81,-.44,;-3.32,-.84,;-2.23,.25,;-2.63,1.74,;-1.54,2.83,;-.05,2.43,;1.04,3.52,;2.52,3.12,;3.61,4.21,;3.21,5.7,;1.73,6.1,;.64,5.01,;4.3,6.79,;5.79,6.39,;6.88,7.48,;6.19,4.9,;5.1,3.81,;5.5,2.32,;6.99,1.93,;7.38,.44,;8.07,3.01,;7.68,4.5,;-4.12,2.14,;-5.21,1.05,)| Show InChI InChI=1S/C27H31ClFN3O2/c28-21-5-3-20(4-6-21)27(33)30-23-8-1-18(2-9-23)11-14-32-15-12-19(13-16-32)26-24-10-7-22(29)17-25(24)34-31-26/h3-7,10,17-19,23H,1-2,8-9,11-16H2,(H,30,33)/t18-,23-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.67	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Aliquots of membrane preparations were thawed at RT, resuspended in assay buffer (D2, D3: 50 mM Tris-HCl, 120 mM NaCl, 5 mM MgCl2, 1 mM EDTA, 5 mM KC...				US Patent US8829029 (2014) BindingDB Entry DOI: 10.7270/Q22B8WSS
					More data for this Ligand-Target Pair