Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1A' and Ligand = 'BDBM50064554'   

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 1A (Rattus norvegicus (rat))	BDBM50064554 ((4-{4-[4-(2-Isopropoxy-phenyl)-piperazin-1-yl]-but...) Show SMILES CC(C)Oc1ccccc1N1CCN(CCCCc2ccc(cc2)C(=O)N2CCCCC2)CC1 Show InChI InChI=1S/C29H41N3O2/c1-24(2)34-28-12-5-4-11-27(28)31-22-20-30(21-23-31)17-9-6-10-25-13-15-26(16-14-25)29(33)32-18-7-3-8-19-32/h4-5,11-16,24H,3,6-10,17-23H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against 5-hydroxytryptamine 1A receptor from rat cerebral cortex				J Med Chem 41: 1997-2009 (1998) Article DOI: 10.1021/jm970164z BindingDB Entry DOI: 10.7270/Q2KK9CG0
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