BindingDB logo
myBDB logout

null

SMILES: CNC(=O)Cn1cc(C2CC2)c(Oc2ccc(cc2)C#N)c1C1CC1

InChI Key: InChIKey=AALHNBNOUAEYHF-UHFFFAOYSA-N

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 6 hits for monomerid = 50318934   
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
Progesterone receptor


(Homo sapiens (Human))
BDBM50318934
PNG
(2-(3-(4-cyanophenoxy)-2,4-dicyclopropyl-1H-pyrrol-...)
Show SMILES CNC(=O)Cn1cc(C2CC2)c(Oc2ccc(cc2)C#N)c1C1CC1
Show InChI InChI=1S/C20H21N3O2/c1-22-18(24)12-23-11-17(14-4-5-14)20(19(23)15-6-7-15)25-16-8-2-13(10-21)3-9-16/h2-3,8-9,11,14-15H,4-7,12H2,1H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 47n/an/an/an/an/an/a



Pfizer PharmaTherapeutics Division

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant progesterone receptor expressed in CHO-MMTV-beta-lactamase cells assessed as inhibition of progesterone-indu...


Bioorg Med Chem Lett 20: 3384-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.018
BindingDB Entry DOI: 10.7270/Q2NK3F6K
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50318934
PNG
(2-(3-(4-cyanophenoxy)-2,4-dicyclopropyl-1H-pyrrol-...)
Show SMILES CNC(=O)Cn1cc(C2CC2)c(Oc2ccc(cc2)C#N)c1C1CC1
Show InChI InChI=1S/C20H21N3O2/c1-22-18(24)12-23-11-17(14-4-5-14)20(19(23)15-6-7-15)25-16-8-2-13(10-21)3-9-16/h2-3,8-9,11,14-15H,4-7,12H2,1H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4.00E+4n/an/an/an/an/an/a



Pfizer PharmaTherapeutics Division

Curated by ChEMBL


Assay Description
Antagonist activity at progesterone receptor in human T47D cells by alkaline phosphatase release


Bioorg Med Chem Lett 20: 3384-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.018
BindingDB Entry DOI: 10.7270/Q2NK3F6K
More data for this
Ligand-Target Pair
Androgen receptor


(Homo sapiens (Human))
BDBM50318934
PNG
(2-(3-(4-cyanophenoxy)-2,4-dicyclopropyl-1H-pyrrol-...)
Show SMILES CNC(=O)Cn1cc(C2CC2)c(Oc2ccc(cc2)C#N)c1C1CC1
Show InChI InChI=1S/C20H21N3O2/c1-22-18(24)12-23-11-17(14-4-5-14)20(19(23)15-6-7-15)25-16-8-2-13(10-21)3-9-16/h2-3,8-9,11,14-15H,4-7,12H2,1H3,(H,22,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Pfizer PharmaTherapeutics Division

Curated by ChEMBL


Assay Description
Inhibition of androgen receptor


Bioorg Med Chem Lett 20: 3384-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.018
BindingDB Entry DOI: 10.7270/Q2NK3F6K
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50318934
PNG
(2-(3-(4-cyanophenoxy)-2,4-dicyclopropyl-1H-pyrrol-...)
Show SMILES CNC(=O)Cn1cc(C2CC2)c(Oc2ccc(cc2)C#N)c1C1CC1
Show InChI InChI=1S/C20H21N3O2/c1-22-18(24)12-23-11-17(14-4-5-14)20(19(23)15-6-7-15)25-16-8-2-13(10-21)3-9-16/h2-3,8-9,11,14-15H,4-7,12H2,1H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Pfizer PharmaTherapeutics Division

Curated by ChEMBL


Assay Description
Inhibition of glucocorticoid receptor


Bioorg Med Chem Lett 20: 3384-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.018
BindingDB Entry DOI: 10.7270/Q2NK3F6K
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50318934
PNG
(2-(3-(4-cyanophenoxy)-2,4-dicyclopropyl-1H-pyrrol-...)
Show SMILES CNC(=O)Cn1cc(C2CC2)c(Oc2ccc(cc2)C#N)c1C1CC1
Show InChI InChI=1S/C20H21N3O2/c1-22-18(24)12-23-11-17(14-4-5-14)20(19(23)15-6-7-15)25-16-8-2-13(10-21)3-9-16/h2-3,8-9,11,14-15H,4-7,12H2,1H3,(H,22,24)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Pfizer PharmaTherapeutics Division

Curated by ChEMBL


Assay Description
Inhibition of estrogen receptor


Bioorg Med Chem Lett 20: 3384-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.018
BindingDB Entry DOI: 10.7270/Q2NK3F6K
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50318934
PNG
(2-(3-(4-cyanophenoxy)-2,4-dicyclopropyl-1H-pyrrol-...)
Show SMILES CNC(=O)Cn1cc(C2CC2)c(Oc2ccc(cc2)C#N)c1C1CC1
Show InChI InChI=1S/C20H21N3O2/c1-22-18(24)12-23-11-17(14-4-5-14)20(19(23)15-6-7-15)25-16-8-2-13(10-21)3-9-16/h2-3,8-9,11,14-15H,4-7,12H2,1H3,(H,22,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Pfizer PharmaTherapeutics Division

Curated by ChEMBL


Assay Description
Inhibition of mineralocorticoid receptor


Bioorg Med Chem Lett 20: 3384-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.018
BindingDB Entry DOI: 10.7270/Q2NK3F6K
More data for this
Ligand-Target Pair