BDBM50665338 CHEMBL6169258

SMILES O=C(Nc1ccc(OC(F)(F)F)c(F)c1)N[C@H]1CC[C@H](Oc2ccc(O)cc2)CC1

InChI Key InChIKey=XXZFDQPPLKUBBR-UHFFFAOYSA-N

Data  2 IC50  12 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 14 hits for monomerid = 50665338   

TargetBifunctional epoxide hydrolase 2(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataIC50: 0.200nMAssay Description:Inhibition of recombinant human sEH assessed as conversion of nonfluorescent MNPC cyano(6-methoxy-naphthalen-2-yl)methyl trans-[(3-phenyloxiran-2-yl)...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetBifunctional epoxide hydrolase 2(Mouse)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataIC50: 0.900nMAssay Description:Inhibition of recombinant mouse sEH assessed as conversion of nonfluorescent MNPC cyano(6-methoxy-naphthalen-2-yl)methyl trans-[(3-phenyloxiran-2-yl)...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetPeroxisome proliferator-activated receptor gamma(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50:  600nMAssay Description:Partial agonist activity at human PPARgamma transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminescen...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetRetinoic acid receptor RXR-alpha(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at RXRalpha (unknown origin) transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminesc...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetOxysterols receptor LXR-alpha(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at LXRalpha (unknown origin) transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminesc...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetBile acid receptor(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at human FXR transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminescence based dual ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetRetinoic acid receptor beta(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at RARbeta (unknown origin) transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminesce...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetRetinoic acid receptor gamma(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at RARgamma (unknown origin) transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminesc...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetNuclear receptor subfamily 1 group I member 3(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at CAR (unknown origin) transfected on HEK293T cells assessed as regulation of CYP3A4 expression incubated for 1 hrs and measured af...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetRetinoic acid receptor alpha(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at RARalpha (unknown origin) transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminesc...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetOxysterols receptor LXR-beta(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at LXRbeta (unknown origin) transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminesce...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetRetinoic acid receptor RXR-gamma(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at RXRgamma (unknown origin) transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminesc...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetPeroxisome proliferator-activated receptor alpha(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50:  2.26E+4nMAssay Description:Partial agonist activity at human PPARalpha transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminescen...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetPeroxisome proliferator-activated receptor delta(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665338BDBM50665338(CHEMBL6169258)
Affinity DataEC50:  9.82E+4nMAssay Description:Partial agonist activity at human PPARdelta transfected in HEK293T cells incubated for 1 hrs and measured after 45 mins of shaking by chemiluminescen...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed