BindingDB logo
myBDB logout

BDBM50219445 1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-methyl-2-((4-methylnaphthalen-1-yl)methyl)pentan-2-ol::CHEMBL235280

SMILES: COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(C)c2ccccc12)C(F)(F)F

InChI Key: InChIKey=KIBFFSPWYJTEGK-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50219445   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50219445
PNG
(1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-met...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(C)c2ccccc12)C(F)(F)F |w:13.14|
Show InChI InChI=1S/C25H26F4O2/c1-16-9-10-17(20-8-6-5-7-19(16)20)14-24(30,25(27,28)29)15-23(2,3)21-13-18(26)11-12-22(21)31-4/h5-13,30H,14-15H2,1-4H3
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.05E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Displacement of TAMRA labeled mifepristone at human mineralocorticoid receptor in insect cell


Bioorg Med Chem Lett 17: 5025-31 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.031
BindingDB Entry DOI: 10.7270/Q2G73FJ2
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50219445
PNG
(1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-met...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(C)c2ccccc12)C(F)(F)F |w:13.14|
Show InChI InChI=1S/C25H26F4O2/c1-16-9-10-17(20-8-6-5-7-19(16)20)14-24(30,25(27,28)29)15-23(2,3)21-13-18(26)11-12-22(21)31-4/h5-13,30H,14-15H2,1-4H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Displacement of TAMRA labeled Dexamethasone at human progesterone receptor in insect cell


Bioorg Med Chem Lett 17: 5025-31 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.031
BindingDB Entry DOI: 10.7270/Q2G73FJ2
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50219445
PNG
(1,1,1-trifluoro-4-(5-fluoro-2-methoxyphenyl)-4-met...)
Show SMILES COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(C)c2ccccc12)C(F)(F)F |w:13.14|
Show InChI InChI=1S/C25H26F4O2/c1-16-9-10-17(20-8-6-5-7-19(16)20)14-24(30,25(27,28)29)15-23(2,3)21-13-18(26)11-12-22(21)31-4/h5-13,30H,14-15H2,1-4H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 58n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Displacement of TAMRA labeled Dexamethasone at human glucocorticoid receptor in insect cell


Bioorg Med Chem Lett 17: 5025-31 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.031
BindingDB Entry DOI: 10.7270/Q2G73FJ2
More data for this
Ligand-Target Pair