null

SMILES: COC(=O)C1C2CCC(CC1c1ccc(cc1)-c1cnc3ccccc3c1)N2C

InChI Key: InChIKey=QYQBPUFRGNLMIF-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50175649   

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
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50175649 (CHEMBL199512 | methyl 8-methyl-3-(4-(quinolin-3-yl...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(cc1)-c1cnc3ccccc3c1)N2C |TLB:28:27:6.7:4.10.9,THB:2:4:6.7:27,11:10:6.7:27| Show InChI InChI=1S/C25H26N2O2/c1-27-20-11-12-23(27)24(25(28)29-2)21(14-20)17-9-7-16(8-10-17)19-13-18-5-3-4-6-22(18)26-15-19/h3-10,13,15,20-21,23-24H,11-12,14H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description Displacement of [3H]paroxetine from SERT in rat frontoparietal cerebral cortex				Bioorg Med Chem Lett 16: 217-20 (2005) Article DOI: 10.1016/j.bmcl.2005.09.016 BindingDB Entry DOI: 10.7270/Q2R210Z2
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50175649 (CHEMBL199512 | methyl 8-methyl-3-(4-(quinolin-3-yl...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(cc1)-c1cnc3ccccc3c1)N2C |TLB:28:27:6.7:4.10.9,THB:2:4:6.7:27,11:10:6.7:27| Show InChI InChI=1S/C25H26N2O2/c1-27-20-11-12-23(27)24(25(28)29-2)21(14-20)17-9-7-16(8-10-17)19-13-18-5-3-4-6-22(18)26-15-19/h3-10,13,15,20-21,23-24H,11-12,14H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	59.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description Displacement of [3H]GBR-12935 from DAT in rat rat frontoparietal cerebral cortex				Bioorg Med Chem Lett 16: 217-20 (2005) Article DOI: 10.1016/j.bmcl.2005.09.016 BindingDB Entry DOI: 10.7270/Q2R210Z2
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50175649 (CHEMBL199512 | methyl 8-methyl-3-(4-(quinolin-3-yl...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(cc1)-c1cnc3ccccc3c1)N2C |TLB:28:27:6.7:4.10.9,THB:2:4:6.7:27,11:10:6.7:27| Show InChI InChI=1S/C25H26N2O2/c1-27-20-11-12-23(27)24(25(28)29-2)21(14-20)17-9-7-16(8-10-17)19-13-18-5-3-4-6-22(18)26-15-19/h3-10,13,15,20-21,23-24H,11-12,14H2,1-2H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description Displacement of [3H]nisoxetine from NET in rat caudate-putamen				Bioorg Med Chem Lett 16: 217-20 (2005) Article DOI: 10.1016/j.bmcl.2005.09.016 BindingDB Entry DOI: 10.7270/Q2R210Z2
					More data for this Ligand-Target Pair