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SMILES: COc1ccc(OCCc2ccc(Br)cc2)cc1CCN

InChI Key: InChIKey=SBJQOCFOTJYSGU-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50104812   

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 2A (Rattus norvegicus (rat))	BDBM50104812 (2-{5-[2-(4-Bromo-phenyl)-ethoxy]-2-methoxy-phenyl}...) Show SMILES COc1ccc(OCCc2ccc(Br)cc2)cc1CCN Show InChI InChI=1S/C17H20BrNO2/c1-20-17-7-6-16(12-14(17)8-10-19)21-11-9-13-2-4-15(18)5-3-13/h2-7,12H,8-11,19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description Binding affinity against rat 5-hydroxytryptamine 2A receptor using [3H]-DOB as radioligand				J Med Chem 44: 3283-91 (2001) BindingDB Entry DOI: 10.7270/Q2MW2GFJ
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50104812 (2-{5-[2-(4-Bromo-phenyl)-ethoxy]-2-methoxy-phenyl}...) Show SMILES COc1ccc(OCCc2ccc(Br)cc2)cc1CCN Show InChI InChI=1S/C17H20BrNO2/c1-20-17-7-6-16(12-14(17)8-10-19)21-11-9-13-2-4-15(18)5-3-13/h2-7,12H,8-11,19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	91	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description Binding affinity against rat 5-hydroxytryptamine 2A receptor using [3H]-Ketanserin as radioligand				J Med Chem 44: 3283-91 (2001) BindingDB Entry DOI: 10.7270/Q2MW2GFJ
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Rattus norvegicus (Rat))	BDBM50104812 (2-{5-[2-(4-Bromo-phenyl)-ethoxy]-2-methoxy-phenyl}...) Show SMILES COc1ccc(OCCc2ccc(Br)cc2)cc1CCN Show InChI InChI=1S/C17H20BrNO2/c1-20-17-7-6-16(12-14(17)8-10-19)21-11-9-13-2-4-15(18)5-3-13/h2-7,12H,8-11,19H2,1H3	KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	115	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description Binding affinity against rat 5-hydroxytryptamine 2C receptor using [3H]-mesulergine as radioligand				J Med Chem 44: 3283-91 (2001) BindingDB Entry DOI: 10.7270/Q2MW2GFJ
					More data for this Ligand-Target Pair