BDBM50115565 4-(4-Chloro-phenyl)-1-(3-chloro-propyl)-piperidine-3-carboxylic acid methyl ester::CHEMBL325562

SMILES: COC(=O)C1CN(CCCCl)CC[C@@H]1c1ccc(Cl)cc1

InChI Key: InChIKey=YYQZHLREDDREEU-GICMACPYSA-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 = 50115565   

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
Norepinephrine Monoamine transporters (Rattus norvegicus)	BDBM50115565 (4-(4-Chloro-phenyl)-1-(3-chloro-propyl)-piperidine...) Show SMILES COC(=O)C1CN(CCCCl)CC[C@@H]1c1ccc(Cl)cc1 Show InChI InChI=1S/C16H21Cl2NO2/c1-21-16(20)15-11-19(9-2-8-17)10-7-14(15)12-3-5-13(18)6-4-12/h3-6,14-15H,2,7-11H2,1H3/t14-,15?/m1/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	441	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity uptake of [3H]NE by norepinephrine transporter in nerve endings obtained from rat brain.				J Med Chem 45: 3161-70 (2002) BindingDB Entry DOI: 10.7270/Q2FT8MR8
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50115565 (4-(4-Chloro-phenyl)-1-(3-chloro-propyl)-piperidine...) Show SMILES COC(=O)C1CN(CCCCl)CC[C@@H]1c1ccc(Cl)cc1 Show InChI InChI=1S/C16H21Cl2NO2/c1-21-16(20)15-11-19(9-2-8-17)10-7-14(15)12-3-5-13(18)6-4-12/h3-6,14-15H,2,7-11H2,1H3/t14-,15?/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.15E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity uptake of [3H]-DA by dopamine transporter in nerve endings obtained from rat brain.				J Med Chem 45: 3161-70 (2002) BindingDB Entry DOI: 10.7270/Q2FT8MR8
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50115565 (4-(4-Chloro-phenyl)-1-(3-chloro-propyl)-piperidine...) Show SMILES COC(=O)C1CN(CCCCl)CC[C@@H]1c1ccc(Cl)cc1 Show InChI InChI=1S/C16H21Cl2NO2/c1-21-16(20)15-11-19(9-2-8-17)10-7-14(15)12-3-5-13(18)6-4-12/h3-6,14-15H,2,7-11H2,1H3/t14-,15?/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity uptake of [3H]5-HT by serotonin transporter in nerve endings obtained from rat brain.				J Med Chem 45: 3161-70 (2002) BindingDB Entry DOI: 10.7270/Q2FT8MR8
					More data for this Ligand-Target Pair