BDBM50396034 CHEMBL586213::TCMDC-139046

SMILES COc1cc2CCN(C(=O)Nc3cc(OC(F)(F)F)cc(c3)-c3cccnc3)c2cc1C(F)(F)F

InChI Key InChIKey=PLPFIMGOJTYGRW-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 50396034   

Target5-hydroxytryptamine receptor 2C(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50396034(TCMDC-139046 | CHEMBL586213)
Affinity DataIC50: 50nMAssay Description:Inhibition of human 5HT2c receptor expressed in CHO-K1 cells assessed as inhibition of 5HT-induced calcium influx measured up to 30 secs by aequorin ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50396034(TCMDC-139046 | CHEMBL586213)
Affinity DataIC50: 2.00E+3nMAssay Description:Inhibition of human CYP2C9 using 7-methoxy-4-triflouromethylcoumarin-3-acetic acid as substrate incubated for 30 mins prior to substrate addition mea...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50396034(TCMDC-139046 | CHEMBL586213)
Affinity DataIC50: 1.30E+4nMAssay Description:Inhibition of human CYP2D6 using 4-methylaminomethyl-7-methoxycoumarin as substrate incubated for 30 mins prior to substrate addition measured up to ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50396034(TCMDC-139046 | CHEMBL586213)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human CYP2C19 using 3-butyryl-7-methoxycoumarin as substrate incubated for 30 mins prior to substrate addition measured up to 10 mins b...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50396034(TCMDC-139046 | CHEMBL586213)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human CYP3A4 using 7-benzyloxyquinoline as substrate incubated for 30 mins prior to substrate addition measured up to 10 mins by fluori...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed