Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2B' and Ligand = 'BDBM50176276'   

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 2B (Homo sapiens (Human))	BDBM50176276 ((S)-N-(2-methoxybenzyl)-1-(1H-pyrrolo[2,3-f]quinol...) Show SMILES COc1ccccc1CN[C@@H](C)Cn1ccc2ccc3ncccc3c12 Show InChI InChI=1S/C22H23N3O/c1-16(24-14-18-6-3-4-8-21(18)26-2)15-25-13-11-17-9-10-20-19(22(17)25)7-5-12-23-20/h3-13,16,24H,14-15H2,1-2H3/t16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	883	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis plc Curated by ChEMBL					Assay Description Displacement of [3H]5HT from human 5HT2B				Bioorg Med Chem Lett 16: 677-80 (2005) Article DOI: 10.1016/j.bmcl.2005.10.029 BindingDB Entry DOI: 10.7270/Q2QV3M27
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50176276 ((S)-N-(2-methoxybenzyl)-1-(1H-pyrrolo[2,3-f]quinol...) Show SMILES COc1ccccc1CN[C@@H](C)Cn1ccc2ccc3ncccc3c12 Show InChI InChI=1S/C22H23N3O/c1-16(24-14-18-6-3-4-8-21(18)26-2)15-25-13-11-17-9-10-20-19(22(17)25)7-5-12-23-20/h3-13,16,24H,14-15H2,1-2H3/t16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	462	n/a	n/a	n/a	n/a
Vernalis plc Curated by ChEMBL					Assay Description Binding to human 5HT2B receptor expressed in CHO cells				Bioorg Med Chem Lett 16: 677-80 (2005) Article DOI: 10.1016/j.bmcl.2005.10.029 BindingDB Entry DOI: 10.7270/Q2QV3M27
					More data for this Ligand-Target Pair