BindingDB logo
myBDB logout

PubMed code 26003343

Compile data set for download or QSAR
Found 10 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
Estrogen receptor


(Homo sapiens (Human))
BDBM50092526
PNG
(CHEMBL3586195)
Show SMILES CC\C(=C(/c1ccc(O)cc1)c1ccc(OCCNCCCCCCCCCCF)cc1)c1ccccc1
Show InChI InChI=1S/C34H44FNO2/c1-2-33(28-14-10-9-11-15-28)34(29-16-20-31(37)21-17-29)30-18-22-32(23-19-30)38-27-26-36-25-13-8-6-4-3-5-7-12-24-35/h9-11,14-23,36-37H,2-8,12-13,24-27H2,1H3/b34-33-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.40n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50092484
PNG
(CHEMBL3586191)
Show SMILES CCCCCCCCCCNCCOc1ccc(cc1)C(=C(\CC)c1ccccc1)\c1ccc(O)cc1
Show InChI InChI=1S/C34H45NO2/c1-3-5-6-7-8-9-10-14-25-35-26-27-37-32-23-19-30(20-24-32)34(29-17-21-31(36)22-18-29)33(4-2)28-15-12-11-13-16-28/h11-13,15-24,35-36H,3-10,14,25-27H2,1-2H3/b34-33-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.60n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50092523
PNG
(CHEMBL3586193)
Show SMILES CCCCCCCCCCCCCCCCNCCOc1ccc(cc1)C(=C(\CC)c1ccccc1)\c1ccc(O)cc1
Show InChI InChI=1S/C40H57NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-20-31-41-32-33-43-38-29-25-36(26-30-38)40(35-23-27-37(42)28-24-35)39(4-2)34-21-18-17-19-22-34/h17-19,21-30,41-42H,3-16,20,31-33H2,1-2H3/b40-39-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.80n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM20608
PNG
(4-Hydroxytamoxifen | 4-Hydroxytamoxifen (9) | 4-[(...)
Show SMILES CC\C(=C(/c1ccc(O)cc1)c1ccc(OCCN(C)C)cc1)c1ccccc1
Show InChI InChI=1S/C26H29NO2/c1-4-25(20-8-6-5-7-9-20)26(21-10-14-23(28)15-11-21)22-12-16-24(17-13-22)29-19-18-27(2)3/h5-17,28H,4,18-19H2,1-3H3/b26-25-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
n/an/a 5.60n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Estrogen receptor


(Homo sapiens (Human))
BDBM50092522
PNG
(CHEMBL3586192)
Show SMILES CCCCCCCCCCCCCCNCCOc1ccc(cc1)C(=C(\CC)c1ccccc1)\c1ccc(O)cc1
Show InChI InChI=1S/C38H53NO2/c1-3-5-6-7-8-9-10-11-12-13-14-18-29-39-30-31-41-36-27-23-34(24-28-36)38(33-21-25-35(40)26-22-33)37(4-2)32-19-16-15-17-20-32/h15-17,19-28,39-40H,3-14,18,29-31H2,1-2H3/b38-37-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 11n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50092501
PNG
(CHEMBL3098274)
Show SMILES CCCCCCCCCCCCNCCOc1ccc(cc1)C(=C(\CC)c1ccccc1)\c1ccc(O)cc1
Show InChI InChI=1S/C36H49NO2/c1-3-5-6-7-8-9-10-11-12-16-27-37-28-29-39-34-25-21-32(22-26-34)36(31-19-23-33(38)24-20-31)35(4-2)30-17-14-13-15-18-30/h13-15,17-26,37-38H,3-12,16,27-29H2,1-2H3/b36-35-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 14n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50092483
PNG
(CHEMBL3586190)
Show SMILES CCCCCCCCNCCOc1ccc(cc1)C(=C(\CC)c1ccccc1)\c1ccc(O)cc1
Show InChI InChI=1S/C32H41NO2/c1-3-5-6-7-8-12-23-33-24-25-35-30-21-17-28(18-22-30)32(27-15-19-29(34)20-16-27)31(4-2)26-13-10-9-11-14-26/h9-11,13-22,33-34H,3-8,12,23-25H2,1-2H3/b32-31-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 53n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50092482
PNG
(CHEMBL3098273)
Show SMILES CCCCCCNCCOc1ccc(cc1)C(=C(\CC)c1ccccc1)\c1ccc(O)cc1
Show InChI InChI=1S/C30H37NO2/c1-3-5-6-10-21-31-22-23-33-28-19-15-26(16-20-28)30(25-13-17-27(32)18-14-25)29(4-2)24-11-8-7-9-12-24/h7-9,11-20,31-32H,3-6,10,21-23H2,1-2H3/b30-29-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 151n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50092525
PNG
(CHEMBL3586194)
Show SMILES CC\C(=C(/c1ccc(O)cc1)c1ccc(OCCNCCCCCCCCCCO)cc1)c1ccccc1
Show InChI InChI=1S/C34H45NO3/c1-2-33(28-14-10-9-11-15-28)34(29-16-20-31(37)21-17-29)30-18-22-32(23-19-30)38-27-25-35-24-12-7-5-3-4-6-8-13-26-36/h9-11,14-23,35-37H,2-8,12-13,24-27H2,1H3/b34-33-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 210n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50092524
PNG
(CHEMBL3098275)
Show SMILES CCCCCCCCCCCCCCCCCCNCCOc1ccc(cc1)C(=C(\CC)c1ccccc1)\c1ccc(O)cc1
Show InChI InChI=1S/C42H61NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-33-43-34-35-45-40-31-27-38(28-32-40)42(37-25-29-39(44)30-26-37)41(4-2)36-23-20-19-21-24-36/h19-21,23-32,43-44H,3-18,22,33-35H2,1-2H3/b42-41-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+5n/an/an/an/an/an/a



National Institute of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of ERalpha (unknown origin) by fluorescence polarization-based competition binding assay


Bioorg Med Chem 23: 3091-6 (2015)


Article DOI: 10.1016/j.bmc.2015.05.002
BindingDB Entry DOI: 10.7270/Q28P6277
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%