BDBM322113 1-{5-[1-(3-Chlorophenyl)ethoxy]-1-(cyclohexylmethyl)-1H-pyrazol-3-yl}-N-methylmethanamine hydrochloride::US10183913, Example 350

SMILES: CNCc1cc(OC(C)c2cccc(Cl)c2)n(CC2CCCCC2)n1

InChI Key: InChIKey=BCKNAJHBZGRSDP-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 322113   

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))	BDBM322113 (1-{5-[1-(3-Chlorophenyl)ethoxy]-1-(cyclohexylmethy...) Show SMILES CNCc1cc(OC(C)c2cccc(Cl)c2)n(CC2CCCCC2)n1 Show InChI InChI=1S/C20H28ClN3O/c1-15(17-9-6-10-18(21)11-17)25-20-12-19(13-22-2)23-24(20)14-16-7-4-3-5-8-16/h6,9-12,15-16,22H,3-5,7-8,13-14H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SUMITOMO DAINIPPON PHARMA CO., LTD. US Patent					Assay Description A solution of 200 μL in total was prepared by mixing 50 μL of [3H] mesulergine (manufactured by GE Healthcare) diluted with 50 mmol/L Tris-...				US Patent US10183913 (2019) BindingDB Entry DOI: 10.7270/Q2MW2K73
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM322113 (1-{5-[1-(3-Chlorophenyl)ethoxy]-1-(cyclohexylmethy...) Show SMILES CNCc1cc(OC(C)c2cccc(Cl)c2)n(CC2CCCCC2)n1 Show InChI InChI=1S/C20H28ClN3O/c1-15(17-9-6-10-18(21)11-17)25-20-12-19(13-22-2)23-24(20)14-16-7-4-3-5-8-16/h6,9-12,15-16,22H,3-5,7-8,13-14H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SUMITOMO DAINIPPON PHARMA CO., LTD. US Patent					Assay Description The [3H] citalopram binding was measured according to the method disclosed in Owens M. J. et al., J. Pharm. Exp. Ther., 283, 1305-1322 (1997). In spe...				US Patent US10183913 (2019) BindingDB Entry DOI: 10.7270/Q2MW2K73
					More data for this Ligand-Target Pair