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BDBM50246183 4-(3,4-dichlorophenoxy)-3-((dimethylamino)methyl)aniline::CHEMBL488911

SMILES: CN(C)Cc1cc(N)ccc1Oc1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=NMVPOKRBXPYPSQ-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50246183   
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
Dopamine D2 receptor and serotonin 2a receptor


(Homo sapiens (Human))
BDBM50246183
PNG
(4-(3,4-dichlorophenoxy)-3-((dimethylamino)methyl)a...)
Show SMILES CN(C)Cc1cc(N)ccc1Oc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H16Cl2N2O/c1-19(2)9-10-7-11(18)3-6-15(10)20-12-4-5-13(16)14(17)8-12/h3-8H,9,18H2,1-2H3
MMDB

Reactome pathway
KEGG

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 724n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from 5HT2A receptor (unknown origin)


Bioorg Med Chem Lett 18: 6088-92 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.028
BindingDB Entry DOI: 10.7270/Q2RJ4JBK
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50246183
PNG
(4-(3,4-dichlorophenoxy)-3-((dimethylamino)methyl)a...)
Show SMILES CN(C)Cc1cc(N)ccc1Oc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C15H16Cl2N2O/c1-19(2)9-10-7-11(18)3-6-15(10)20-12-4-5-13(16)14(17)8-12/h3-8H,9,18H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 4.99n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of serotonin reuptake at SERT (unknown origin)


Bioorg Med Chem Lett 18: 6088-92 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.028
BindingDB Entry DOI: 10.7270/Q2RJ4JBK
More data for this
Ligand-Target Pair