BDBM50324229 3-(4-Bromo-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-1-yl)-N,N-dimethylpropan-1-amine::CHEMBL1215759

SMILES: CN(C)CCCC1(OCc2c1cccc2Br)c1ccc(F)cc1

InChI Key: InChIKey=BEZKFNRZGGBEQX-UHFFFAOYSA-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 = 50324229   

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))	BDBM50324229 (3-(4-Bromo-1-(4-fluorophenyl)-1,3-dihydroisobenzof...) Show SMILES CN(C)CCCC1(OCc2c1cccc2Br)c1ccc(F)cc1 Show InChI InChI=1S/C19H21BrFNO/c1-22(2)12-4-11-19(14-7-9-15(21)10-8-14)17-5-3-6-18(20)16(17)13-23-19/h3,5-10H,4,11-13H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.87	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse-Intramural Research Program Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat brain stem by scintillation counting				J Med Chem 53: 6112-21 (2010) Article DOI: 10.1021/jm1005034 BindingDB Entry DOI: 10.7270/Q22J6C2G
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50324229 (3-(4-Bromo-1-(4-fluorophenyl)-1,3-dihydroisobenzof...) Show SMILES CN(C)CCCC1(OCc2c1cccc2Br)c1ccc(F)cc1 Show InChI InChI=1S/C19H21BrFNO/c1-22(2)12-4-11-19(14-7-9-15(21)10-8-14)17-5-3-6-18(20)16(17)13-23-19/h3,5-10H,4,11-13H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	216	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse-Intramural Research Program Curated by ChEMBL					Assay Description Displacement of [3H]WIN-35428 from DAT in rat caudate-putamen by scintillation counting				J Med Chem 53: 6112-21 (2010) Article DOI: 10.1021/jm1005034 BindingDB Entry DOI: 10.7270/Q22J6C2G
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus (rat))	BDBM50324229 (3-(4-Bromo-1-(4-fluorophenyl)-1,3-dihydroisobenzof...) Show SMILES CN(C)CCCC1(OCc2c1cccc2Br)c1ccc(F)cc1 Show InChI InChI=1S/C19H21BrFNO/c1-22(2)12-4-11-19(14-7-9-15(21)10-8-14)17-5-3-6-18(20)16(17)13-23-19/h3,5-10H,4,11-13H2,1-2H3	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.17E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse-Intramural Research Program Curated by ChEMBL					Assay Description Displacement of [3H]nisoxetine from NET in rat frontal cortex by scintillation counting				J Med Chem 53: 6112-21 (2010) Article DOI: 10.1021/jm1005034 BindingDB Entry DOI: 10.7270/Q22J6C2G
					More data for this Ligand-Target Pair