Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 7' and Ligand = 'BDBM50544139'   

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 7 (Homo sapiens (Human))	BDBM50544139 (CHEMBL4633786) Show SMILES CN1CCc2cccc3-c4cc5nc(N)sc5cc4CC1c23 Show InChI InChI=1S/C18H17N3S/c1-21-6-5-10-3-2-4-12-13-9-14-16(22-18(19)20-14)8-11(13)7-15(21)17(10)12/h2-4,8-9,15H,5-7H2,1H3,(H2,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
City University of New York Curated by ChEMBL					Assay Description Displacement of [3H]-LSD from human 5-HT7A receptor expresssed in stable HEK cell membrane incubated for 90 mins by microbeta counting method				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2020.115578 BindingDB Entry DOI: 10.7270/Q22B92KJ
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50544139 (CHEMBL4633786) Show SMILES CN1CCc2cccc3-c4cc5nc(N)sc5cc4CC1c23 Show InChI InChI=1S/C18H17N3S/c1-21-6-5-10-3-2-4-12-13-9-14-16(22-18(19)20-14)8-11(13)7-15(21)17(10)12/h2-4,8-9,15H,5-7H2,1H3,(H2,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
City University of New York Curated by ChEMBL					Assay Description Antagonist activity at human recombinant 5-HT7 receptor expressed in CHOK1 Hunter cell preincubated for 30 mins followed by incubation with agonist f...				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2020.115578 BindingDB Entry DOI: 10.7270/Q22B92KJ
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50544139 (CHEMBL4633786) Show SMILES CN1CCc2cccc3-c4cc5nc(N)sc5cc4CC1c23 Show InChI InChI=1S/C18H17N3S/c1-21-6-5-10-3-2-4-12-13-9-14-16(22-18(19)20-14)8-11(13)7-15(21)17(10)12/h2-4,8-9,15H,5-7H2,1H3,(H2,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
City University of New York Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5-HT7 receptor expressed in CHOK1 Hunter cell incubated for 30 to 60 mins by hit-hunter cAMP assay based chemil...				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2020.115578 BindingDB Entry DOI: 10.7270/Q22B92KJ
					More data for this Ligand-Target Pair