Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 3A' and Ligand = 'BDBM410129'   

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 3A (Homo sapiens (Human))	BDBM410129 (US10370370, Compound (R)-22) Show SMILES Cc1cc2onc(N[C@H]3CN4CCC3CC4)c2cc1F |r,wU:8.7,TLB:7:8:11.12:14.15,(2.96,-.49,;1.6,-1,;1.35,-2.52,;-.09,-3.06,;-.9,-4.52,;-2.35,-4.44,;-2.58,-2.91,;-4.01,-2.35,;-5.22,-3.31,;-4.93,-4.73,;-6.33,-4.09,;-6.07,-2.15,;-6.53,-1.02,;-6.6,-2.69,;-8.1,-3.35,;-7.9,-4.76,;-1.28,-2.09,;-1.03,-.57,;.41,-.03,;.65,1.41,)| Show InChI InChI=1S/C15H18FN3O/c1-9-6-14-11(7-12(9)16)15(18-20-14)17-13-8-19-4-2-10(13)3-5-19/h6-7,10,13H,2-5,8H2,1H3,(H,17,18)/t13-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Axovant Sciences GmbH US Patent					Assay Description h-5HT3: In brief, Chinese Hamster Ovary (CHO) cells stably expressing human 5-HT3 serotonin receptors, grown to confluence in 175 cm2 flasks. Followi...				US Patent US10370370 (2019) BindingDB Entry DOI: 10.7270/Q2348NRP
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