BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 42 hits Enz. Inhib. hit(s) with all data for entry = 50035173   
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))
BDBM18627
PNG
((10S,11S,14S,15S,17R)-17-[4-(dimethylamino)phenyl]...)
Show SMILES [H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@@H](C1=C3CCC(=O)C=C3CC[C@@]21[H])c1ccc(cc1)N(C)C |r,c:14,20|
Show InChI InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

DrugBank
PDB
PubMed
1.10n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Progesterone receptor


(Homo sapiens (Human))
BDBM50066523
PNG
(2,2,4-Trimethyl-6-(3-nitro-phenyl)-1,2-dihydro-qui...)
Show SMILES CC1=CC(C)(C)Nc2ccc(cc12)-c1cccc(c1)[N+]([O-])=O |t:1|
Show InChI InChI=1S/C18H18N2O2/c1-12-11-18(2,3)19-17-8-7-14(10-16(12)17)13-5-4-6-15(9-13)20(21)22/h4-11,19H,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
20n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105572
PNG
(1-Benzyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES [O-][N+](=O)c1cccc(c1)-[c-]1ccc2nc(=[SH+])n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H14N3O2S/c24-23(25)17-8-4-7-15(11-17)16-9-10-18-19(12-16)22(20(26)21-18)13-14-5-2-1-3-6-14/h1-12H,13H2/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
30n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105564
PNG
(6-(3-Chloro-phenyl)-3H-benzothiazol-2-one | CHEMBL...)
Show SMILES Clc1cccc(c1)-c1ccc2[nH]c(=O)sc2c1
Show InChI InChI=1S/C13H8ClNOS/c14-10-3-1-2-8(6-10)9-4-5-11-12(7-9)17-13(16)15-11/h1-7H,(H,15,16)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
127n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105561
PNG
(1-Benzyl-6-(3-chloro-phenyl)-1,3-dihydro-benzoimid...)
Show SMILES Clc1cccc(c1)-c1ccc2[nH]c(=S)n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H15ClN2S/c21-17-8-4-7-15(11-17)16-9-10-18-19(12-16)23(20(24)22-18)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

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



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105566
PNG
(6-(3-Nitro-phenyl)-3H-benzothiazol-2-one | CHEMBL3...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1ccc2[n-]c(=[OH+])sc2c1
Show InChI InChI=1S/C13H8N2O3S/c16-13-14-11-5-4-9(7-12(11)19-13)8-2-1-3-10(6-8)15(17)18/h1-7H,(H,14,16)
PDB

KEGG

UniProtKB/SwissProt

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

Patents

PubMed
332n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105563
PNG
(1-Benzyl-6-(3-chloro-phenyl)-1,3-dihydro-benzoimid...)
Show SMILES Clc1cccc(c1)-c1ccc2[nH]c(=O)n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H15ClN2O/c21-17-8-4-7-15(11-17)16-9-10-18-19(12-16)23(20(24)22-18)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
521n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105565
PNG
(6-(3-Chloro-phenyl)-1-isopropyl-1,3-dihydro-benzoi...)
Show SMILES CC(C)n1c2cc(ccc2[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C16H15ClN2O/c1-10(2)19-15-9-12(6-7-14(15)18-16(19)20)11-4-3-5-13(17)8-11/h3-10H,1-2H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
525n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105560
PNG
(1-Isopropyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoim...)
Show SMILES CC(C)n1c2c[c-](ccc2nc1=[OH+])-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C16H14N3O3/c1-10(2)18-15-9-12(6-7-14(15)17-16(18)20)11-4-3-5-13(8-11)19(21)22/h3-10H,1-2H3/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
525n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105562
PNG
(1-Benzyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES [O-][N+](=O)c1cccc(c1)-[c-]1ccc2nc(=[OH+])n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H14N3O3/c24-20-21-18-10-9-16(15-7-4-8-17(11-15)23(25)26)12-19(18)22(20)13-14-5-2-1-3-6-14/h1-12H,13H2/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
714n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105559
PNG
(1-Benzyl-5-(3-chloro-phenyl)-1,3-dihydro-benzoimid...)
Show SMILES Clc1cccc(c1)-c1ccc2n(Cc3ccccc3)c(=O)[nH]c2c1
Show InChI InChI=1S/C20H15ClN2O/c21-17-8-4-7-15(11-17)16-9-10-19-18(12-16)22-20(24)23(19)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
3.13E+3n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105568
PNG
(1-Methyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES Cn1c2c[c-](ccc2nc1=[OH+])-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C14H10N3O3/c1-16-13-8-10(5-6-12(13)15-14(16)18)9-3-2-4-11(7-9)17(19)20/h2-8H,1H3/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

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



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105567
PNG
(1-Benzyl-5-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1cc[c-]2n(Cc3ccccc3)c(=[OH+])nc2c1
Show InChI InChI=1S/C20H14N3O3/c24-20-21-18-12-16(15-7-4-8-17(11-15)23(25)26)9-10-19(18)22(20)13-14-5-2-1-3-6-14/h1-12H,13H2/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

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



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM18627
PNG
((10S,11S,14S,15S,17R)-17-[4-(dimethylamino)phenyl]...)
Show SMILES [H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@@H](C1=C3CCC(=O)C=C3CC[C@@]21[H])c1ccc(cc1)N(C)C |r,c:14,20|
Show InChI InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

DrugBank
PDB
PubMed
n/an/a 0.200n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Progesterone receptor


(Homo sapiens (Human))
BDBM18627
PNG
((10S,11S,14S,15S,17R)-17-[4-(dimethylamino)phenyl]...)
Show SMILES [H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@@H](C1=C3CCC(=O)C=C3CC[C@@]21[H])c1ccc(cc1)N(C)C |r,c:14,20|
Show InChI InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

DrugBank
PDB
PubMed
n/an/a 0.300n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Progesterone receptor


(Homo sapiens (Human))
BDBM50105572
PNG
(1-Benzyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES [O-][N+](=O)c1cccc(c1)-[c-]1ccc2nc(=[SH+])n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H14N3O2S/c24-23(25)17-8-4-7-15(11-17)16-9-10-18-19(12-16)22(20(26)21-18)13-14-5-2-1-3-6-14/h1-12H,13H2/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 10n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105561
PNG
(1-Benzyl-6-(3-chloro-phenyl)-1,3-dihydro-benzoimid...)
Show SMILES Clc1cccc(c1)-c1ccc2[nH]c(=S)n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H15ClN2S/c21-17-8-4-7-15(11-17)16-9-10-18-19(12-16)23(20(24)22-18)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 17n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105571
PNG
(6-(3-Chloro-phenyl)-1-ethyl-1,3-dihydro-benzoimida...)
Show SMILES CCn1c2cc(ccc2[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C15H13ClN2O/c1-2-18-14-9-11(6-7-13(14)17-15(18)19)10-4-3-5-12(16)8-10/h3-9H,2H2,1H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 29n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50066523
PNG
(2,2,4-Trimethyl-6-(3-nitro-phenyl)-1,2-dihydro-qui...)
Show SMILES CC1=CC(C)(C)Nc2ccc(cc12)-c1cccc(c1)[N+]([O-])=O |t:1|
Show InChI InChI=1S/C18H18N2O2/c1-12-11-18(2,3)19-17-8-7-14(10-16(12)17)13-5-4-6-15(9-13)20(21)22/h4-11,19H,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 41n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50066523
PNG
(2,2,4-Trimethyl-6-(3-nitro-phenyl)-1,2-dihydro-qui...)
Show SMILES CC1=CC(C)(C)Nc2ccc(cc12)-c1cccc(c1)[N+]([O-])=O |t:1|
Show InChI InChI=1S/C18H18N2O2/c1-12-11-18(2,3)19-17-8-7-14(10-16(12)17)13-5-4-6-15(9-13)20(21)22/h4-11,19H,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 42n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105562
PNG
(1-Benzyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES [O-][N+](=O)c1cccc(c1)-[c-]1ccc2nc(=[OH+])n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H14N3O3/c24-20-21-18-10-9-16(15-7-4-8-17(11-15)23(25)26)12-19(18)22(20)13-14-5-2-1-3-6-14/h1-12H,13H2/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 62n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105560
PNG
(1-Isopropyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoim...)
Show SMILES CC(C)n1c2c[c-](ccc2nc1=[OH+])-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C16H14N3O3/c1-10(2)18-15-9-12(6-7-14(15)17-16(18)20)11-4-3-5-13(8-11)19(21)22/h3-10H,1-2H3/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 73n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105566
PNG
(6-(3-Nitro-phenyl)-3H-benzothiazol-2-one | CHEMBL3...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1ccc2[n-]c(=[OH+])sc2c1
Show InChI InChI=1S/C13H8N2O3S/c16-13-14-11-5-4-9(7-12(11)19-13)8-2-1-3-10(6-8)15(17)18/h1-7H,(H,14,16)
PDB

KEGG

UniProtKB/SwissProt

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

Patents

PubMed
n/an/a 84n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105571
PNG
(6-(3-Chloro-phenyl)-1-ethyl-1,3-dihydro-benzoimida...)
Show SMILES CCn1c2cc(ccc2[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C15H13ClN2O/c1-2-18-14-9-11(6-7-13(14)17-15(18)19)10-4-3-5-12(16)8-10/h3-9H,2H2,1H3,(H,17,19)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 106n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105565
PNG
(6-(3-Chloro-phenyl)-1-isopropyl-1,3-dihydro-benzoi...)
Show SMILES CC(C)n1c2cc(ccc2[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C16H15ClN2O/c1-10(2)19-15-9-12(6-7-14(15)18-16(19)20)11-4-3-5-13(17)8-11/h3-10H,1-2H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 113n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105563
PNG
(1-Benzyl-6-(3-chloro-phenyl)-1,3-dihydro-benzoimid...)
Show SMILES Clc1cccc(c1)-c1ccc2[nH]c(=O)n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H15ClN2O/c21-17-8-4-7-15(11-17)16-9-10-18-19(12-16)23(20(24)22-18)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 113n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105560
PNG
(1-Isopropyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoim...)
Show SMILES CC(C)n1c2c[c-](ccc2nc1=[OH+])-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C16H14N3O3/c1-10(2)18-15-9-12(6-7-14(15)17-16(18)20)11-4-3-5-13(8-11)19(21)22/h3-10H,1-2H3/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 136n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105562
PNG
(1-Benzyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES [O-][N+](=O)c1cccc(c1)-[c-]1ccc2nc(=[OH+])n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H14N3O3/c24-20-21-18-10-9-16(15-7-4-8-17(11-15)23(25)26)12-19(18)22(20)13-14-5-2-1-3-6-14/h1-12H,13H2/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 257n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105564
PNG
(6-(3-Chloro-phenyl)-3H-benzothiazol-2-one | CHEMBL...)
Show SMILES Clc1cccc(c1)-c1ccc2[nH]c(=O)sc2c1
Show InChI InChI=1S/C13H8ClNOS/c14-10-3-1-2-8(6-10)9-4-5-11-12(7-9)17-13(16)15-11/h1-7H,(H,15,16)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 265n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105566
PNG
(6-(3-Nitro-phenyl)-3H-benzothiazol-2-one | CHEMBL3...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1ccc2[n-]c(=[OH+])sc2c1
Show InChI InChI=1S/C13H8N2O3S/c16-13-14-11-5-4-9(7-12(11)19-13)8-2-1-3-10(6-8)15(17)18/h1-7H,(H,14,16)
PDB

KEGG

UniProtKB/SwissProt

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

Patents

PubMed
n/an/a 326n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105565
PNG
(6-(3-Chloro-phenyl)-1-isopropyl-1,3-dihydro-benzoi...)
Show SMILES CC(C)n1c2cc(ccc2[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C16H15ClN2O/c1-10(2)19-15-9-12(6-7-14(15)18-16(19)20)11-4-3-5-13(17)8-11/h3-10H,1-2H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 412n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105563
PNG
(1-Benzyl-6-(3-chloro-phenyl)-1,3-dihydro-benzoimid...)
Show SMILES Clc1cccc(c1)-c1ccc2[nH]c(=O)n(Cc3ccccc3)c2c1
Show InChI InChI=1S/C20H15ClN2O/c21-17-8-4-7-15(11-17)16-9-10-18-19(12-16)23(20(24)22-18)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 412n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105564
PNG
(6-(3-Chloro-phenyl)-3H-benzothiazol-2-one | CHEMBL...)
Show SMILES Clc1cccc(c1)-c1ccc2[nH]c(=O)sc2c1
Show InChI InChI=1S/C13H8ClNOS/c14-10-3-1-2-8(6-10)9-4-5-11-12(7-9)17-13(16)15-11/h1-7H,(H,15,16)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 460n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105570
PNG
(6-(3-Chloro-phenyl)-1-methyl-1,3-dihydro-benzoimid...)
Show SMILES Cn1c2cc(ccc2[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C14H11ClN2O/c1-17-13-8-10(5-6-12(13)16-14(17)18)9-3-2-4-11(15)7-9/h2-8H,1H3,(H,16,18)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105568
PNG
(1-Methyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES Cn1c2c[c-](ccc2nc1=[OH+])-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C14H10N3O3/c1-16-13-8-10(5-6-12(13)15-14(16)18)9-3-2-4-11(7-9)17(19)20/h2-8H,1H3/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105570
PNG
(6-(3-Chloro-phenyl)-1-methyl-1,3-dihydro-benzoimid...)
Show SMILES Cn1c2cc(ccc2[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C14H11ClN2O/c1-17-13-8-10(5-6-12(13)16-14(17)18)9-3-2-4-11(15)7-9/h2-8H,1H3,(H,16,18)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 1.37E+3n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105568
PNG
(1-Methyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES Cn1c2c[c-](ccc2nc1=[OH+])-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C14H10N3O3/c1-16-13-8-10(5-6-12(13)15-14(16)18)9-3-2-4-11(7-9)17(19)20/h2-8H,1H3/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 1.53E+3n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105559
PNG
(1-Benzyl-5-(3-chloro-phenyl)-1,3-dihydro-benzoimid...)
Show SMILES Clc1cccc(c1)-c1ccc2n(Cc3ccccc3)c(=O)[nH]c2c1
Show InChI InChI=1S/C20H15ClN2O/c21-17-8-4-7-15(11-17)16-9-10-19-18(12-16)22-20(24)23(19)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 3.06E+3n/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone induced PRE-luciferase activity in CV-cells


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105567
PNG
(1-Benzyl-5-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1cc[c-]2n(Cc3ccccc3)c(=[OH+])nc2c1
Show InChI InChI=1S/C20H14N3O3/c24-20-21-18-12-16(15-7-4-8-17(11-15)23(25)26)9-10-19(18)22(20)13-14-5-2-1-3-6-14/h1-12H,13H2/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

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



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105567
PNG
(1-Benzyl-5-(3-nitro-phenyl)-1,3-dihydro-benzoimida...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1cc[c-]2n(Cc3ccccc3)c(=[OH+])nc2c1
Show InChI InChI=1S/C20H14N3O3/c24-20-21-18-12-16(15-7-4-8-17(11-15)23(25)26)9-10-19(18)22(20)13-14-5-2-1-3-6-14/h1-12H,13H2/q-1/p+1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

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



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity towards progesterone receptor was measured


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105559
PNG
(1-Benzyl-5-(3-chloro-phenyl)-1,3-dihydro-benzoimid...)
Show SMILES Clc1cccc(c1)-c1ccc2n(Cc3ccccc3)c(=O)[nH]c2c1
Show InChI InChI=1S/C20H15ClN2O/c21-17-8-4-7-15(11-17)16-9-10-19-18(12-16)22-20(24)23(19)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

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



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50105569
PNG
(1-Benzyl-5-(3-chloro-phenyl)-1,3-dihydro-benzoimid...)
Show SMILES Clc1cccc(c1)-c1ccc2n(Cc3ccccc3)c(=S)[nH]c2c1
Show InChI InChI=1S/C20H15ClN2S/c21-17-8-4-7-15(11-17)16-9-10-19-18(12-16)22-20(24)23(19)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

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



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against progesterone stimulated alkaline phosphatase activity in T47D human breast carcinoma cell line


Bioorg Med Chem Lett 11: 2747-50 (2001)


BindingDB Entry DOI: 10.7270/Q2222V92
More data for this
Ligand-Target Pair