BindingDB logo
myBDB logout

Patent code US9422324

Compile Data Set for Download or QSAR
Found 8 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
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM17292
PNG
((1S,10R,11S,14S,15S)-15-methyltetracyclo[8.7.0.0^{...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

US Patent
n/an/a 1.70n/an/an/an/an/an/a



Endece LLC

US Patent


Assay Description
Estrogen receptor-negative CV-1 kidney cells are maintained in Dulbecco's modified Eagle's medium with 4.5 g/L glucose supplemented with 10% fetal bo...


Citation and Details
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM17292
PNG
((1S,10R,11S,14S,15S)-15-methyltetracyclo[8.7.0.0^{...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@H]2O
Show InChI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

US Patent
n/an/a 1.90n/an/an/an/an/an/a



Endece LLC

US Patent


Assay Description
Estrogen receptor-negative CV-1 kidney cells are maintained in Dulbecco's modified Eagle's medium with 4.5 g/L glucose supplemented with 10% fetal bo...


Citation and Details
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM240787
PNG
(US9422324, 1)
Show SMILES COC[C@@H]1C[C@H]2[C@@H]3CCC(O)C3CC[C@@H]2c2ccc(O)cc12
Show InChI InChI=1S/C19H26O3/c1-22-10-11-8-18-14(13-3-2-12(20)9-17(11)13)4-5-16-15(18)6-7-19(16)21/h2-3,9,11,14-16,18-21H,4-8,10H2,1H3/t11-,14+,15+,16?,18+,19?/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 21n/an/an/an/an/an/a



Endece LLC

US Patent


Assay Description
Estrogen receptor-negative CV-1 kidney cells are maintained in Dulbecco's modified Eagle's medium with 4.5 g/L glucose supplemented with 10% fetal bo...


Citation and Details
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM240786
PNG
(US9422324, I)
Show SMILES COCCCCCC[C@@H]1C[C@H]2[C@@H]3CC[C@H](O)C3CC[C@@H]2c2ccc(O)cc12
Show InChI InChI=1S/C24H36O3/c1-27-13-5-3-2-4-6-16-14-23-19(18-8-7-17(25)15-22(16)18)9-10-21-20(23)11-12-24(21)26/h7-8,15-16,19-21,23-26H,2-6,9-14H2,1H3/t16-,19-,20-,21?,23-,24+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 70n/an/an/an/an/an/a



Endece LLC

US Patent


Assay Description
Estrogen receptor-negative CV-1 kidney cells are maintained in Dulbecco's modified Eagle's medium with 4.5 g/L glucose supplemented with 10% fetal bo...


Citation and Details
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM240788
PNG
(US9422324, B)
Show SMILES COC[C@@H]1CC2C3CC[C@H](O)[C@@]3(C)CCC2c2ccc(O)cc12
Show InChI InChI=1S/C20H28O3/c1-20-8-7-15-14-4-3-13(21)10-16(14)12(11-23-2)9-17(15)18(20)5-6-19(20)22/h3-4,10,12,15,17-19,21-22H,5-9,11H2,1-2H3/t12-,15?,17?,18?,19-,20-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 80n/an/an/an/an/an/a



Endece LLC

US Patent


Assay Description
Estrogen receptor-negative CV-1 kidney cells are maintained in Dulbecco's modified Eagle's medium with 4.5 g/L glucose supplemented with 10% fetal bo...


Citation and Details
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM240786
PNG
(US9422324, I)
Show SMILES COCCCCCC[C@@H]1C[C@H]2[C@@H]3CC[C@H](O)C3CC[C@@H]2c2ccc(O)cc12
Show InChI InChI=1S/C24H36O3/c1-27-13-5-3-2-4-6-16-14-23-19(18-8-7-17(25)15-22(16)18)9-10-21-20(23)11-12-24(21)26/h7-8,15-16,19-21,23-26H,2-6,9-14H2,1H3/t16-,19-,20-,21?,23-,24+/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 100n/an/an/an/an/an/a



Endece LLC

US Patent


Assay Description
Estrogen receptor-negative CV-1 kidney cells are maintained in Dulbecco's modified Eagle's medium with 4.5 g/L glucose supplemented with 10% fetal bo...


Citation and Details
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM240788
PNG
(US9422324, B)
Show SMILES COC[C@@H]1CC2C3CC[C@H](O)[C@@]3(C)CCC2c2ccc(O)cc12
Show InChI InChI=1S/C20H28O3/c1-20-8-7-15-14-4-3-13(21)10-16(14)12(11-23-2)9-17(15)18(20)5-6-19(20)22/h3-4,10,12,15,17-19,21-22H,5-9,11H2,1-2H3/t12-,15?,17?,18?,19-,20-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 495n/an/an/an/an/an/a



Endece LLC

US Patent


Assay Description
Estrogen receptor-negative CV-1 kidney cells are maintained in Dulbecco's modified Eagle's medium with 4.5 g/L glucose supplemented with 10% fetal bo...


Citation and Details
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM240787
PNG
(US9422324, 1)
Show SMILES COC[C@@H]1C[C@H]2[C@@H]3CCC(O)C3CC[C@@H]2c2ccc(O)cc12
Show InChI InChI=1S/C19H26O3/c1-22-10-11-8-18-14(13-3-2-12(20)9-17(11)13)4-5-16-15(18)6-7-19(16)21/h2-3,9,11,14-16,18-21H,4-8,10H2,1H3/t11-,14+,15+,16?,18+,19?/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.25E+3n/an/an/an/an/an/a



Endece LLC

US Patent


Assay Description
Estrogen receptor-negative CV-1 kidney cells are maintained in Dulbecco's modified Eagle's medium with 4.5 g/L glucose supplemented with 10% fetal bo...


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%