BDBM50070042 CHEMBL3407810

SMILES Fc1cccc(CCCNCCc2ccnc(n2)-n2ccnc2)c1

InChI Key InChIKey=GTABKUMYLUXCIH-UHFFFAOYSA-N

Data  9 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50070042   

TargetCytochrome P450 3A4(Human)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataIC50: 2.50E+3nMAssay Description:Inhibition of human CYP3A4 using 7-benzyloxy-4-(trifluoromethyl)coumarin as substrate assessed as formation of 7-hydroxy-4-trifluoromethylcoumarin in...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed
TargetNitric oxide synthase, brain(Rat)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataKi:  19nMAssay Description:Binding affinity to recombinant rat neuronal NOS overexpressed in Escherichia coli assessed as production of nitric oxide from L-arginine measured fo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed
TargetNitric oxide synthase, brain(Human)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataKi:  193nMAssay Description:Binding affinity to recombinant human neuronal NOS overexpressed in Escherichia coli assessed as production of nitric oxide from L-arginine measured ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed
TargetAlpha-2C adrenergic receptor(Human)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataKi:  200nMAssay Description:Binding affinity to human adrenergic alpha-2C receptor after 90 mins by radioligand displacement assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed
TargetSigma non-opioid intracellular receptor 1(Human)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataKi:  200nMAssay Description:Binding affinity to human sigma-1 receptor after 90 mins by radioligand displacement assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataKi:  500nMAssay Description:Binding affinity to human 5-HT1A receptor after 90 mins by radioligand displacement assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataKi:  500nMAssay Description:Binding affinity to human 5-HT2A receptor after 90 mins by radioligand displacement assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataKi:  500nMAssay Description:Binding affinity to human dopamine D3 receptor after 90 mins by radioligand displacement assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed
TargetNitric oxide synthase, inducible(Mouse)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataKi:  770nMAssay Description:Binding affinity to recombinant mouse macrophage inducible NOS overexpressed in Escherichia coli assessed as production of nitric oxide from L-argini...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed
TargetNitric oxide synthase, endothelial(Bovine)
Northwestern University

Curated by ChEMBL
LigandPNGBDBM50070042(CHEMBL3407810)
Affinity DataKi:  4.95E+3nMAssay Description:Binding affinity to recombinant bovine endothelial NOS overexpressed in Escherichia coli assessed as production of nitric oxide from L-arginine measu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2016
Entry Details Article
PubMed