Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2C' and Ligand = 'BDBM322117'   

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 2C (Homo sapiens (Human))	BDBM322117 (1-{5-[(2-fluorobenzyl)oxy]-1-(3-methylbutyl)-1H-py...) Show SMILES CNCc1cc(OCc2ccccc2F)n(CCC(C)C)n1 Show InChI InChI=1S/C17H24FN3O/c1-13(2)8-9-21-17(10-15(20-21)11-19-3)22-12-14-6-4-5-7-16(14)18/h4-7,10,13,19H,8-9,11-12H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description A solution of 200 μL in total was prepared by mixing 50 μL of [3H] mesulergine (manufactured by GE Healthcare) diluted with 50 mmol/L Tris-...				Citation and Details BindingDB Entry DOI: 10.7270/Q2BV7KTS
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM322117 (1-{5-[(2-fluorobenzyl)oxy]-1-(3-methylbutyl)-1H-py...) Show SMILES CNCc1cc(OCc2ccccc2F)n(CCC(C)C)n1 Show InChI InChI=1S/C17H24FN3O/c1-13(2)8-9-21-17(10-15(20-21)11-19-3)22-12-14-6-4-5-7-16(14)18/h4-7,10,13,19H,8-9,11-12H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SUMITOMO DAINIPPON PHARMA CO., LTD. US Patent					Assay Description A solution of 200 μL in total was prepared by mixing 50 μL of [3H] mesulergine (manufactured by GE Healthcare) diluted with 50 mmol/L Tris-...				US Patent US10183913 (2019) BindingDB Entry DOI: 10.7270/Q2MW2K73
					More data for this Ligand-Target Pair