BindingDB logo
myBDB logout

PubMed code 22260770

Compile data set for download or QSAR
Found 12 hits of Enzyme Inhibition Constant Data   
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
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50364466
PNG
(CHEMBL1950695)
Show SMILES CCc1nc2cc(ccc2o1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#CC)[C@@H]2CCC3=CC(=O)CCC3=C12 |r,t:29,36|
Show InChI InChI=1S/C30H33NO3/c1-4-13-30(33)14-12-24-22-9-6-18-15-20(32)8-10-21(18)28(22)23(17-29(24,30)3)19-7-11-26-25(16-19)31-27(5-2)34-26/h7,11,15-16,22-24,33H,5-6,8-10,12,14,17H2,1-3H3/t22-,23+,24-,29-,30-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at glucocorticoid receptor in human A549 cells assessed as inhibition of dexamethasone-induced transcription at GRE after 24 hrs ...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50364465
PNG
(CHEMBL1950694)
Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2oc(C)nc2c1 |r,c:18,t:11|
Show InChI InChI=1S/C29H31NO3/c1-4-12-29(32)13-11-24-22-8-5-18-14-20(31)7-9-21(18)27(22)23(16-28(24,29)3)19-6-10-26-25(15-19)30-17(2)33-26/h6,10,14-15,22-24,32H,5,7-9,11,13,16H2,1-3H3/t22-,23+,24-,28-,29-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 23n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at glucocorticoid receptor in human A549 cells assessed as inhibition of dexamethasone-induced transcription at GRE after 24 hrs ...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50364465
PNG
(CHEMBL1950694)
Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2oc(C)nc2c1 |r,c:18,t:11|
Show InChI InChI=1S/C29H31NO3/c1-4-12-29(32)13-11-24-22-8-5-18-14-20(31)7-9-21(18)27(22)23(16-28(24,29)3)19-6-10-26-25(15-19)30-17(2)33-26/h6,10,14-15,22-24,32H,5,7-9,11,13,16H2,1-3H3/t22-,23+,24-,28-,29-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 35n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at progesterone receptor in human T47D cells assessed as inhibition of progesterone-induced alkaline phosphatase activity after 2...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50364468
PNG
(CHEMBL1950698)
Show SMILES CC#C[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2ocnc2c1)NC=O |r,c:17,t:10|
Show InChI InChI=1S/C29H30N2O3/c1-3-11-29(31-16-32)12-10-24-22-7-4-18-13-20(33)6-8-21(18)27(22)23(15-28(24,29)2)19-5-9-26-25(14-19)30-17-34-26/h5,9,13-14,16-17,22-24H,4,6-8,10,12,15H2,1-2H3,(H,31,32)/t22-,23+,24-,28-,29-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 41n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at progesterone receptor in human T47D cells assessed as inhibition of progesterone-induced alkaline phosphatase activity after 2...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50364464
PNG
(CHEMBL1950693)
Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2ocnc2c1 |r,c:18,t:11|
Show InChI InChI=1S/C28H29NO3/c1-3-11-28(31)12-10-23-21-7-4-17-13-19(30)6-8-20(17)26(21)22(15-27(23,28)2)18-5-9-25-24(14-18)29-16-32-25/h5,9,13-14,16,21-23,31H,4,6-8,10,12,15H2,1-2H3/t21-,22+,23-,27-,28-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 45n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at glucocorticoid receptor in human A549 cells assessed as inhibition of dexamethasone-induced transcription at GRE after 24 hrs ...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50364469
PNG
(CHEMBL1950696)
Show SMILES CC#C[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2oc(nc2c1)C(F)(F)F)NC=O |r,c:17,t:10|
Show InChI InChI=1S/C30H29F3N2O3/c1-3-11-29(34-16-36)12-10-23-21-7-4-17-13-19(37)6-8-20(17)26(21)22(15-28(23,29)2)18-5-9-25-24(14-18)35-27(38-25)30(31,32)33/h5,9,13-14,16,21-23H,4,6-8,10,12,15H2,1-2H3,(H,34,36)/t21-,22+,23-,28-,29-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 46n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at progesterone receptor in human T47D cells assessed as inhibition of progesterone-induced alkaline phosphatase activity after 2...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50364468
PNG
(CHEMBL1950698)
Show SMILES CC#C[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2ocnc2c1)NC=O |r,c:17,t:10|
Show InChI InChI=1S/C29H30N2O3/c1-3-11-29(31-16-32)12-10-24-22-7-4-18-13-20(33)6-8-21(18)27(22)23(15-28(24,29)2)19-5-9-26-25(14-19)30-17-34-26/h5,9,13-14,16-17,22-24H,4,6-8,10,12,15H2,1-2H3,(H,31,32)/t22-,23+,24-,28-,29-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 60n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at glucocorticoid receptor in human A549 cells assessed as inhibition of dexamethasone-induced transcription at GRE after 24 hrs ...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50364467
PNG
(CHEMBL1950697)
Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2oc(nc2c1)C(F)(F)F |r,c:18,t:11|
Show InChI InChI=1S/C29H28F3NO3/c1-3-11-28(35)12-10-22-20-7-4-16-13-18(34)6-8-19(16)25(20)21(15-27(22,28)2)17-5-9-24-23(14-17)33-26(36-24)29(30,31)32/h5,9,13-14,20-22,35H,4,6-8,10,12,15H2,1-2H3/t20-,21+,22-,27-,28-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 61n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at glucocorticoid receptor in human A549 cells assessed as inhibition of dexamethasone-induced transcription at GRE after 24 hrs ...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50364466
PNG
(CHEMBL1950695)
Show SMILES CCc1nc2cc(ccc2o1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#CC)[C@@H]2CCC3=CC(=O)CCC3=C12 |r,t:29,36|
Show InChI InChI=1S/C30H33NO3/c1-4-13-30(33)14-12-24-22-9-6-18-15-20(32)8-10-21(18)28(22)23(17-29(24,30)3)19-7-11-26-25(16-19)31-27(5-2)34-26/h7,11,15-16,22-24,33H,5-6,8-10,12,14,17H2,1-3H3/t22-,23+,24-,29-,30-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 65n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at progesterone receptor in human T47D cells assessed as inhibition of progesterone-induced alkaline phosphatase activity after 2...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50364467
PNG
(CHEMBL1950697)
Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2oc(nc2c1)C(F)(F)F |r,c:18,t:11|
Show InChI InChI=1S/C29H28F3NO3/c1-3-11-28(35)12-10-22-20-7-4-16-13-18(34)6-8-19(16)25(20)21(15-27(22,28)2)17-5-9-24-23(14-17)33-26(36-24)29(30,31)32/h5,9,13-14,20-22,35H,4,6-8,10,12,15H2,1-2H3/t20-,21+,22-,27-,28-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 85n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at progesterone receptor in human T47D cells assessed as inhibition of progesterone-induced alkaline phosphatase activity after 2...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))		BDBM50364464
PNG
(CHEMBL1950693)
Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2ocnc2c1 |r,c:18,t:11|
Show InChI InChI=1S/C28H29NO3/c1-3-11-28(31)12-10-23-21-7-4-17-13-19(30)6-8-20(17)26(21)22(15-27(23,28)2)18-5-9-25-24(14-18)29-16-32-25/h5,9,13-14,16,21-23,31H,4,6-8,10,12,15H2,1-2H3/t21-,22+,23-,27-,28-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 101n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at progesterone receptor in human T47D cells assessed as inhibition of progesterone-induced alkaline phosphatase activity after 2...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))		BDBM50364469
PNG
(CHEMBL1950696)
Show SMILES CC#C[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc2oc(nc2c1)C(F)(F)F)NC=O |r,c:17,t:10|
Show InChI InChI=1S/C30H29F3N2O3/c1-3-11-29(34-16-36)12-10-23-21-7-4-17-13-19(37)6-8-20(17)26(21)22(15-28(23,29)2)18-5-9-25-24(14-18)35-27(38-25)30(31,32)33/h5,9,13-14,16,21-23H,4,6-8,10,12,15H2,1-2H3,(H,34,36)/t21-,22+,23-,28-,29-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 142n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at glucocorticoid receptor in human A549 cells assessed as inhibition of dexamethasone-induced transcription at GRE after 24 hrs ...

Bioorg Med Chem Lett 22: 1705-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.110
BindingDB Entry DOI: 10.7270/Q2QF8TB2
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%