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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Progesterone receptor' and Ligand = 'BDBM50072705'   
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))
BDBM50072705
PNG
(5-Butyl-2,2,4,9-tetramethyl-2,5-dihydro-1H-6-oxa-1...)
Show SMILES CCCCC1Oc2ccc(C)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:22|
Show InChI InChI=1S/C24H29NO/c1-6-7-8-21-23-17(18-13-15(2)9-12-20(18)26-21)10-11-19-22(23)16(3)14-24(4,5)25-19/h9-14,21,25H,6-8H2,1-5H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
1.20n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Binding affinity was determined against hPR-A (human progesterone receptor) using progesterone radioligand in competitive binding assay


Bioorg Med Chem Lett 8: 3365-70 (1999)


BindingDB Entry DOI: 10.7270/Q2BC402X
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072705
PNG
(5-Butyl-2,2,4,9-tetramethyl-2,5-dihydro-1H-6-oxa-1...)
Show SMILES CCCCC1Oc2ccc(C)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:22|
Show InChI InChI=1S/C24H29NO/c1-6-7-8-21-23-17(18-13-15(2)9-12-20(18)26-21)10-11-19-22(23)16(3)14-24(4,5)25-19/h9-14,21,25H,6-8H2,1-5H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/an/an/a 16n/an/an/an/a



Ligand Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Agonist activity was determined against hPR (human progesterone receptor) compared to that of progesterone (100%)


Bioorg Med Chem Lett 8: 3365-70 (1999)


BindingDB Entry DOI: 10.7270/Q2BC402X
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072705
PNG
(5-Butyl-2,2,4,9-tetramethyl-2,5-dihydro-1H-6-oxa-1...)
Show SMILES CCCCC1Oc2ccc(C)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:22|
Show InChI InChI=1S/C24H29NO/c1-6-7-8-21-23-17(18-13-15(2)9-12-20(18)26-21)10-11-19-22(23)16(3)14-24(4,5)25-19/h9-14,21,25H,6-8H2,1-5H3
PDB

KEGG

UniProtKB/SwissProt

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

Similars

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



Ligand Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Binding affinity was determined against hPR-A (human progesterone receptor) using progesterone radioligand in competitive binding assay


Bioorg Med Chem Lett 8: 3365-70 (1999)


BindingDB Entry DOI: 10.7270/Q2BC402X
More data for this
Ligand-Target Pair