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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Progesterone receptor' and Ligand = 'BDBM50251799'   
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))
BDBM50251799
PNG
(4-(4,4-Diallyl-3,4-dihydro-1,3-dioxoisoquinolin-2(...)
Show SMILES C=CCC1(CC=C)C(=O)N(C(=O)c2ccccc12)c1ccc(cc1)C#N
Show InChI InChI=1S/C22H18N2O2/c1-3-13-22(14-4-2)19-8-6-5-7-18(19)20(25)24(21(22)26)17-11-9-16(15-23)10-12-17/h3-12H,1-2,13-14H2
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 110n/an/an/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Antagonist activity at progesterone receptor in human T47D cells assessed as inhibition of progesterone-induced alkaline phosphatase activity


Bioorg Med Chem 16: 7046-54 (2008)


Article DOI: 10.1016/j.bmc.2008.05.016
BindingDB Entry DOI: 10.7270/Q2VX0G9H
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50251799
PNG
(4-(4,4-Diallyl-3,4-dihydro-1,3-dioxoisoquinolin-2(...)
Show SMILES C=CCC1(CC=C)C(=O)N(C(=O)c2ccccc12)c1ccc(cc1)C#N
Show InChI InChI=1S/C22H18N2O2/c1-3-13-22(14-4-2)19-8-6-5-7-18(19)20(25)24(21(22)26)17-11-9-16(15-23)10-12-17/h3-12H,1-2,13-14H2
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 150n/an/an/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Antagonist activity at human progesterone receptor expressed in CHO cells assessed as inhibition of progesterone-induced luciferase activity by repor...


Bioorg Med Chem 16: 7046-54 (2008)


Article DOI: 10.1016/j.bmc.2008.05.016
BindingDB Entry DOI: 10.7270/Q2VX0G9H
More data for this
Ligand-Target Pair