BDBM50504810 CHEMBL4442855

SMILES Oc1ccc(cc1)-c1ccc(CNCCc2c[nH]c3ncc(F)cc23)o1

InChI Key InChIKey=VTRMFVAGEAFJTR-UHFFFAOYSA-N

Data  5 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50504810   

Target5-hydroxytryptamine receptor 6(Human)
Polish Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50504810(CHEMBL4442855)
Affinity DataKi:  25nMAssay Description:Displacement of [3H]-LSD from human 5-HT6R expressed in HEK293 cells after 1 hr by microbeta plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Polish Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50504810(CHEMBL4442855)
Affinity DataKi:  32nMAssay Description:Binding affinity to human 5-HT2AR expressed in HEK293 cells by competitive binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Polish Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50504810(CHEMBL4442855)
Affinity DataKi:  505nMAssay Description:Displacement of [3H]-raclopride from human D2R expressed in HEK293 cells after 1 hr by microbeta plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Polish Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50504810(CHEMBL4442855)
Affinity DataKi:  6.20E+3nMAssay Description:Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in HEK293 cells after 1 hr by microbeta plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Polish Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50504810(CHEMBL4442855)
Affinity DataIC50: 7.80E+3nMAssay Description:Inhibition of human CYP3A4 preincubated for 5 mins followed by NADPH addition and measured after 30 mins by luminescence based microplate reader anal...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Polish Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50504810(CHEMBL4442855)
Affinity DataIC50: 8.40E+3nMAssay Description:Inhibition of human CYP2D6 preincubated for 5 mins followed by NADPH addition and measured after 45 mins by luminescence based microplate reader anal...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 7(Human)
Polish Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50504810(CHEMBL4442855)
Affinity DataKi:  1.38E+4nMAssay Description:Displacement of [3H]-CT from human 5-HT7 receptor expressed in HEK293 cells after 1 hr by microbeta plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed