Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1A' and Ligand = 'BDBM50516858'   

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 (Homo sapiens (Human))	BDBM50516858 (CHEMBL4466243) Show SMILES COc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCCC(C2)c2c[nH]c3ccc(F)cc23)c1=O |(34.44,-5.01,;33.1,-5.77,;31.77,-5,;31.78,-3.46,;30.44,-2.68,;29.1,-3.46,;29.1,-4.99,;30.43,-5.76,;30.43,-7.3,;29.1,-8.07,;27.77,-7.29,;26.44,-8.07,;26.44,-9.61,;27.77,-10.37,;29.09,-9.61,;30.41,-10.38,;30.4,-11.92,;31.75,-9.62,;33.08,-10.4,;34.42,-9.63,;35.75,-10.41,;37.09,-9.65,;38.42,-10.43,;39.74,-9.67,;41.07,-10.45,;41.06,-11.99,;39.72,-12.75,;38.4,-11.97,;39.71,-14.29,;38.45,-15.18,;38.91,-16.65,;40.45,-16.66,;41.47,-17.82,;42.97,-17.51,;43.46,-16.05,;44.97,-15.74,;42.44,-14.9,;40.94,-15.21,;31.76,-8.08,;33.1,-7.31,)| Show InChI InChI=1S/C32H37FN4O3/c1-40-29-12-3-2-10-24(29)30-28-11-4-5-17-36(28)32(39)37(31(30)38)18-7-6-15-35-16-8-9-22(21-35)26-20-34-27-14-13-23(33)19-25(26)27/h2-3,10,12-14,19-20,22,34H,4-9,11,15-18,21H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	40	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]8-OH-DPAT from human 5-HT1A receptor expressed in CHO-K1 cell membranes incubated for 60 mins by microbeta scintillation counting...				Eur J Med Chem 180: 383-397 (2019) Article DOI: 10.1016/j.ejmech.2019.07.027 BindingDB Entry DOI: 10.7270/Q23B63H7
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