BDBM50306847 CHEMBL601249::N-(Cyclopropylmethyl)-4-methoxy-N-(3-(4-phenylpiperazin-1-yl)propyl)benzenesulfonamide

SMILES: COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CC1

InChI Key: InChIKey=KCQYIQQSKRODHM-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50306847   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50306847 (CHEMBL601249 | N-(Cyclopropylmethyl)-4-methoxy-N-(...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CC1 Show InChI InChI=1S/C24H33N3O3S/c1-30-23-10-12-24(13-11-23)31(28,29)27(20-21-8-9-21)15-5-14-25-16-18-26(19-17-25)22-6-3-2-4-7-22/h2-4,6-7,10-13,21H,5,8-9,14-20H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	691	n/a	n/a	n/a	n/a	n/a	n/a
Ewha Womans University Curated by ChEMBL					Assay Description Displacement of [3H]mesulergine from human recombinant 5HT2C receptor expressed in CHO-K1 cells				Bioorg Med Chem 18: 1665-75 (2010) Article DOI: 10.1016/j.bmc.2009.12.067 BindingDB Entry DOI: 10.7270/Q2R78F99
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50306847 (CHEMBL601249 | N-(Cyclopropylmethyl)-4-methoxy-N-(...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CC1 Show InChI InChI=1S/C24H33N3O3S/c1-30-23-10-12-24(13-11-23)31(28,29)27(20-21-8-9-21)15-5-14-25-16-18-26(19-17-25)22-6-3-2-4-7-22/h2-4,6-7,10-13,21H,5,8-9,14-20H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	136	n/a	n/a	n/a	n/a	n/a	n/a
Ewha Womans University Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from human recombinant 5HT2A receptor expressed in avCHO-K1 cells				Bioorg Med Chem 18: 1665-75 (2010) Article DOI: 10.1016/j.bmc.2009.12.067 BindingDB Entry DOI: 10.7270/Q2R78F99
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50306847 (CHEMBL601249 | N-(Cyclopropylmethyl)-4-methoxy-N-(...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(CCCN1CCN(CC1)c1ccccc1)CC1CC1 Show InChI InChI=1S/C24H33N3O3S/c1-30-23-10-12-24(13-11-23)31(28,29)27(20-21-8-9-21)15-5-14-25-16-18-26(19-17-25)22-6-3-2-4-7-22/h2-4,6-7,10-13,21H,5,8-9,14-20H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	121	n/a	n/a	n/a	n/a	n/a	n/a
Ewha Womans University Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human recombinant 5HT7 receptor expressed in CHO cells				Bioorg Med Chem 18: 1665-75 (2010) Article DOI: 10.1016/j.bmc.2009.12.067 BindingDB Entry DOI: 10.7270/Q2R78F99
					More data for this Ligand-Target Pair