BDBM50236725 CHEMBL4061726

SMILES: CNC(C)C(=O)c1ccc(cc1)C(F)(F)F

InChI Key: InChIKey=QLAWAIJPXNKWGH-UHFFFAOYSA-N

Data: 2 EC50

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 = 50236725   

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 (Homo sapiens (Human))	BDBM50236725 (CHEMBL4061726) Show SMILES CNC(C)C(=O)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C11H12F3NO/c1-7(15-2)10(16)8-3-5-9(6-4-8)11(12,13)14/h3-7,15H,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	190	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description Activity at SERT (unknown origin) assessed as release of [3H]HT				J Med Chem 60: 2605-2628 (2017) Article DOI: 10.1021/acs.jmedchem.7b00085 BindingDB Entry DOI: 10.7270/Q2DJ5HWM
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50236725 (CHEMBL4061726) Show SMILES CNC(C)C(=O)c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C11H12F3NO/c1-7(15-2)10(16)8-3-5-9(6-4-8)11(12,13)14/h3-7,15H,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description Activity at DAT (unknown origin) assessed as release of [3H]DA				J Med Chem 60: 2605-2628 (2017) Article DOI: 10.1021/acs.jmedchem.7b00085 BindingDB Entry DOI: 10.7270/Q2DJ5HWM
					More data for this Ligand-Target Pair