BDBM50582442 CHEMBL5075475

SMILES CC(C)Nc1nc2C=CN(Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)C(C)=O

InChI Key InChIKey=KZHFXWSUAVCDNU-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50582442   

TargetG-protein coupled receptor 6(Human)
Takeda California

Curated by ChEMBL
LigandPNGBDBM50582442(CHEMBL5075475)
Affinity DataEC50:  9.60E+4nMAssay Description:Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/5/2023
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Takeda California

Curated by ChEMBL
LigandPNGBDBM50582442(CHEMBL5075475)
Affinity DataIC50: 3.16E+4nMAssay Description:Inhibition of CYP2D6 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/5/2023
Entry Details Article
PubMed