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BDBM50021215 CHEMBL553385::[3-(3,4-Dichloro-phenyl)-6-fluoro-indan-1-yl]-dimethyl-amine; hydrochloride

SMILES: CN(C)C1CC(c2ccc(F)cc12)c1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=AZWHYTXMVWKSPU-UHFFFAOYSA-N

Data: 6 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50021215   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Norepinephrine Monoamine transporters


(Rattus norvegicus)
BDBM50021215
PNG
(CHEMBL553385 | [3-(3,4-Dichloro-phenyl)-6-fluoro-i...)
Show SMILES CN(C)C1CC(c2ccc(F)cc12)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H16Cl2FN/c1-21(2)17-9-13(10-3-6-15(18)16(19)7-10)12-5-4-11(20)8-14(12)17/h3-8,13,17H,9H2,1-2H3
Reactome pathway
KEGG

UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 21n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of noradrenaline uptake in rat synaptosomal fraction


J Med Chem 28: 1817-28 (1986)


Article DOI: 10.1021/jm00150a012
BindingDB Entry DOI: 10.7270/Q29W0G1M
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50021215
PNG
(CHEMBL553385 | [3-(3,4-Dichloro-phenyl)-6-fluoro-i...)
Show SMILES CN(C)C1CC(c2ccc(F)cc12)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H16Cl2FN/c1-21(2)17-9-13(10-3-6-15(18)16(19)7-10)12-5-4-11(20)8-14(12)17/h3-8,13,17H,9H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 5-HT uptake in rat synaptosomal fraction


J Med Chem 28: 1817-28 (1986)


Article DOI: 10.1021/jm00150a012
BindingDB Entry DOI: 10.7270/Q29W0G1M
More data for this
Ligand-Target Pair
Monoamine transporters; Norepininephrine & dopamine


(Rattus norvegicus)
BDBM50021215
PNG
(CHEMBL553385 | [3-(3,4-Dichloro-phenyl)-6-fluoro-i...)
Show SMILES CN(C)C1CC(c2ccc(F)cc12)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H16Cl2FN/c1-21(2)17-9-13(10-3-6-15(18)16(19)7-10)12-5-4-11(20)8-14(12)17/h3-8,13,17H,9H2,1-2H3
Reactome pathway
KEGG

UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.70n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of noradrenaline uptake in rat synaptosomal fraction


J Med Chem 28: 1817-28 (1986)


Article DOI: 10.1021/jm00150a012
BindingDB Entry DOI: 10.7270/Q29W0G1M
More data for this
Ligand-Target Pair
Monoamine transporters; Norepininephrine & dopamine


(Rattus norvegicus (rat))
BDBM50021215
PNG
(CHEMBL553385 | [3-(3,4-Dichloro-phenyl)-6-fluoro-i...)
Show SMILES CN(C)C1CC(c2ccc(F)cc12)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H16Cl2FN/c1-21(2)17-9-13(10-3-6-15(18)16(19)7-10)12-5-4-11(20)8-14(12)17/h3-8,13,17H,9H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 12n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of dopamine uptake in rat synaptosomal fraction


J Med Chem 28: 1817-28 (1986)


Article DOI: 10.1021/jm00150a012
BindingDB Entry DOI: 10.7270/Q29W0G1M
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50021215
PNG
(CHEMBL553385 | [3-(3,4-Dichloro-phenyl)-6-fluoro-i...)
Show SMILES CN(C)C1CC(c2ccc(F)cc12)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H16Cl2FN/c1-21(2)17-9-13(10-3-6-15(18)16(19)7-10)12-5-4-11(20)8-14(12)17/h3-8,13,17H,9H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 5-HT uptake in rat synaptosomal fraction


J Med Chem 28: 1817-28 (1986)


Article DOI: 10.1021/jm00150a012
BindingDB Entry DOI: 10.7270/Q29W0G1M
More data for this
Ligand-Target Pair
Monoamine transporters; Norepininephrine & dopamine


(Rattus norvegicus (rat))
BDBM50021215
PNG
(CHEMBL553385 | [3-(3,4-Dichloro-phenyl)-6-fluoro-i...)
Show SMILES CN(C)C1CC(c2ccc(F)cc12)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H16Cl2FN/c1-21(2)17-9-13(10-3-6-15(18)16(19)7-10)12-5-4-11(20)8-14(12)17/h3-8,13,17H,9H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 31n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of dopamine uptake in rat synaptosomal fraction


J Med Chem 28: 1817-28 (1986)


Article DOI: 10.1021/jm00150a012
BindingDB Entry DOI: 10.7270/Q29W0G1M
More data for this
Ligand-Target Pair