BDBM50257617 CHEMBL492556::N-((2,3-dihydrobenzofuran-3-yl)methyl)-N-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7-sulfonamide

SMILES: CN(CC1COc2ccccc12)S(=O)(=O)c1ccc2CCNCCc2c1

InChI Key: InChIKey=OPBJBLKJIWYZGA-UHFFFAOYSA-N

Data: 2 KI  2 EC50

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 4 hits for monomerid = 50257617   

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))	BDBM50257617 (CHEMBL492556 | N-((2,3-dihydrobenzofuran-3-yl)meth...) Show SMILES CN(CC1COc2ccccc12)S(=O)(=O)c1ccc2CCNCCc2c1 Show InChI InChI=1S/C20H24N2O3S/c1-22(13-17-14-25-20-5-3-2-4-19(17)20)26(23,24)18-7-6-15-8-10-21-11-9-16(15)12-18/h2-7,12,17,21H,8-11,13-14H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	58	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Displacement of [3H]mesulergine form human recombinant 5HT2C receptor expressed in mouse Swiss 3T3 cells by scintillation proximity assay				Bioorg Med Chem Lett 19: 1871-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.071 BindingDB Entry DOI: 10.7270/Q2GB23XH
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50257617 (CHEMBL492556 | N-((2,3-dihydrobenzofuran-3-yl)meth...) Show SMILES CN(CC1COc2ccccc12)S(=O)(=O)c1ccc2CCNCCc2c1 Show InChI InChI=1S/C20H24N2O3S/c1-22(13-17-14-25-20-5-3-2-4-19(17)20)26(23,24)18-7-6-15-8-10-21-11-9-16(15)12-18/h2-7,12,17,21H,8-11,13-14H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.99E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Binding affinity to human ERG				Bioorg Med Chem Lett 19: 1871-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.071 BindingDB Entry DOI: 10.7270/Q2GB23XH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50257617 (CHEMBL492556 | N-((2,3-dihydrobenzofuran-3-yl)meth...) Show SMILES CN(CC1COc2ccccc12)S(=O)(=O)c1ccc2CCNCCc2c1 Show InChI InChI=1S/C20H24N2O3S/c1-22(13-17-14-25-20-5-3-2-4-19(17)20)26(23,24)18-7-6-15-8-10-21-11-9-16(15)12-18/h2-7,12,17,21H,8-11,13-14H2,1H3	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	>9.94E+3	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2B receptor by cell-based system				Bioorg Med Chem Lett 19: 1871-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.071 BindingDB Entry DOI: 10.7270/Q2GB23XH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50257617 (CHEMBL492556 | N-((2,3-dihydrobenzofuran-3-yl)meth...) Show SMILES CN(CC1COc2ccccc12)S(=O)(=O)c1ccc2CCNCCc2c1 Show InChI InChI=1S/C20H24N2O3S/c1-22(13-17-14-25-20-5-3-2-4-19(17)20)26(23,24)18-7-6-15-8-10-21-11-9-16(15)12-18/h2-7,12,17,21H,8-11,13-14H2,1H3	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	41	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as calcium mobilization by FLIPR assay				Bioorg Med Chem Lett 19: 1871-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.071 BindingDB Entry DOI: 10.7270/Q2GB23XH
					More data for this Ligand-Target Pair