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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Progesterone receptor' and Ligand = 'BDBM50298037'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Progesterone receptor


(Homo sapiens (Human))
BDBM50298037
PNG
((S)-2-chloro-4-(ethyl(1-methylpyrrolidin-3-yl)amin...)
Show SMILES CCN([C@H]1CCN(C)C1)c1ccc(C#N)c(Cl)c1 |r|
Show InChI InChI=1S/C14H18ClN3/c1-3-18(13-6-7-17(2)10-13)12-5-4-11(9-16)14(15)8-12/h4-5,8,13H,3,6-7,10H2,1-2H3/t13-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to PR by fluorescence polarization based competition binding assay


Bioorg Med Chem Lett 19: 4777-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.055
BindingDB Entry DOI: 10.7270/Q2TB16XG
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50298037
PNG
((S)-2-chloro-4-(ethyl(1-methylpyrrolidin-3-yl)amin...)
Show SMILES CCN([C@H]1CCN(C)C1)c1ccc(C#N)c(Cl)c1 |r|
Show InChI InChI=1S/C14H18ClN3/c1-3-18(13-6-7-17(2)10-13)12-5-4-11(9-16)14(15)8-12/h4-5,8,13H,3,6-7,10H2,1-2H3/t13-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

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



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at PR expressed in african green monkey CV-1 cells by luciferase reporter assay


Bioorg Med Chem Lett 19: 4777-80 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.055
BindingDB Entry DOI: 10.7270/Q2TB16XG
More data for this
Ligand-Target Pair