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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Progesterone receptor' and Ligand = 'BDBM50072719'   
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))
BDBM50072719
PNG
(2,2,4,5-Tetramethyl-2,5-dihydro-1H-6-oxa-1-aza-chr...)
Show SMILES CC1Oc2ccccc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:18|
Show InChI InChI=1S/C20H21NO/c1-12-11-20(3,4)21-16-10-9-15-14-7-5-6-8-17(14)22-13(2)19(15)18(12)16/h5-11,13,21H,1-4H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
3.30n/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))
BDBM50072719
PNG
(2,2,4,5-Tetramethyl-2,5-dihydro-1H-6-oxa-1-aza-chr...)
Show SMILES CC1Oc2ccccc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:18|
Show InChI InChI=1S/C20H21NO/c1-12-11-20(3,4)21-16-10-9-15-14-7-5-6-8-17(14)22-13(2)19(15)18(12)16/h5-11,13,21H,1-4H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/an/an/a 2.07E+3n/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))
BDBM50072719
PNG
(2,2,4,5-Tetramethyl-2,5-dihydro-1H-6-oxa-1-aza-chr...)
Show SMILES CC1Oc2ccccc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:18|
Show InChI InChI=1S/C20H21NO/c1-12-11-20(3,4)21-16-10-9-15-14-7-5-6-8-17(14)22-13(2)19(15)18(12)16/h5-11,13,21H,1-4H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/an/an/a 43n/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