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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with all data for assayid = 7 entry = 50012537   
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))
BDBM50558137
PNG
(CHEMBL4749536)
Show SMILES CC[C@@](C(=O)OC)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 400n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at progesterone receptor (unknown origin) by PathHunter assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2016.04.052
BindingDB Entry DOI: 10.7270/Q2S46WP4
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50558152
PNG
(CHEMBL4747722)
Show SMILES COC(=O)C(c1ccc(cc1)-c1ccccc1Cl)n1ccc2c(NS(C)(=O)=O)cccc12
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at progesterone receptor (unknown origin) by PathHunter assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2016.04.052
BindingDB Entry DOI: 10.7270/Q2S46WP4
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50558138
PNG
(CHEMBL4792628)
Show SMILES CC[C@](C(=O)OC)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.60E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at progesterone receptor (unknown origin) by PathHunter assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2016.04.052
BindingDB Entry DOI: 10.7270/Q2S46WP4
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50510665
PNG
(CHEMBL4439903)
Show SMILES CC[C@](CO)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|
Show InChI InChI=1S/C19H21ClN2O3S/c1-3-19(13-23,14-7-9-15(20)10-8-14)22-12-11-16-17(21-26(2,24)25)5-4-6-18(16)22/h4-12,21,23H,3,13H2,1-2H3/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.70E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at progesterone receptor (unknown origin) by PathHunter assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2016.04.052
BindingDB Entry DOI: 10.7270/Q2S46WP4
More data for this
Ligand-Target Pair