BDBM50193216 (3S,4S)-methyl 1-methyl-4-(4-(thiophen-3-yl)phenyl)piperidine-3-carboxylate::CHEMBL213823

SMILES: COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(cc1)-c1ccsc1

InChI Key: InChIKey=ZCVCAILQYFJDEQ-IAGOWNOFSA-N

Data: 3 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 3 hits for monomerid = 50193216   

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))	BDBM50193216 ((3S,4S)-methyl 1-methyl-4-(4-(thiophen-3-yl)phenyl...) Show SMILES COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(cc1)-c1ccsc1 Show InChI InChI=1S/C18H21NO2S/c1-19-9-7-16(17(11-19)18(20)21-2)14-5-3-13(4-6-14)15-8-10-22-12-15/h3-6,8,10,12,16-17H,7,9,11H2,1-2H3/t16-,17-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	31.8	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]cyanoimipramine from SERT in rat cerebral cortex homogenate				Bioorg Med Chem Lett 16: 5222-5 (2006) Article DOI: 10.1016/j.bmcl.2006.07.013 BindingDB Entry DOI: 10.7270/Q2N29WMF
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50193216 ((3S,4S)-methyl 1-methyl-4-(4-(thiophen-3-yl)phenyl...) Show SMILES COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(cc1)-c1ccsc1 Show InChI InChI=1S/C18H21NO2S/c1-19-9-7-16(17(11-19)18(20)21-2)14-5-3-13(4-6-14)15-8-10-22-12-15/h3-6,8,10,12,16-17H,7,9,11H2,1-2H3/t16-,17-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	598	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]beta-CIT from DAT in rat caudate homogenate				Bioorg Med Chem Lett 16: 5222-5 (2006) Article DOI: 10.1016/j.bmcl.2006.07.013 BindingDB Entry DOI: 10.7270/Q2N29WMF
					More data for this Ligand-Target Pair
Norepinephrine Monoamine transporters (Rattus norvegicus)	BDBM50193216 ((3S,4S)-methyl 1-methyl-4-(4-(thiophen-3-yl)phenyl...) Show SMILES COC(=O)[C@@H]1CN(C)CC[C@@H]1c1ccc(cc1)-c1ccsc1 Show InChI InChI=1S/C18H21NO2S/c1-19-9-7-16(17(11-19)18(20)21-2)14-5-3-13(4-6-14)15-8-10-22-12-15/h3-6,8,10,12,16-17H,7,9,11H2,1-2H3/t16-,17-/m1/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+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 cerebral cortex				Bioorg Med Chem Lett 16: 5222-5 (2006) Article DOI: 10.1016/j.bmcl.2006.07.013 BindingDB Entry DOI: 10.7270/Q2N29WMF
					More data for this Ligand-Target Pair