Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2C' and Ligand = 'BDBM50176275'   

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))	BDBM50176275 ((S)-N-(cyclohexylmethyl)-1-(1H-pyrrolo[2,3-f]quino...) Show SMILES C[C@@H](Cn1ccc2ccc3ncccc3c12)NCC1CCCCC1 Show InChI InChI=1S/C21H27N3/c1-16(23-14-17-6-3-2-4-7-17)15-24-13-11-18-9-10-20-19(21(18)24)8-5-12-22-20/h5,8-13,16-17,23H,2-4,6-7,14-15H2,1H3/t16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	78	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 5HT2C				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 2C (Homo sapiens (Human))	BDBM50176275 ((S)-N-(cyclohexylmethyl)-1-(1H-pyrrolo[2,3-f]quino...) Show SMILES C[C@@H](Cn1ccc2ccc3ncccc3c12)NCC1CCCCC1 Show InChI InChI=1S/C21H27N3/c1-16(23-14-17-6-3-2-4-7-17)15-24-13-11-18-9-10-20-19(21(18)24)8-5-12-22-20/h5,8-13,16-17,23H,2-4,6-7,14-15H2,1H3/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	348	n/a	n/a	n/a	n/a
Vernalis plc Curated by ChEMBL					Assay Description Binding to human 5HT2C 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