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Compile Data Set for Download or QSAR

Found 7 hits of kd for UniProtKB: Q62986   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Estrogen receptor


(RAT-Rattus norvegicus)
BDBM8903
PNG
((1S,2R,10S,11S,14S,15S)-14-acetyl-2,15-dimethyltet...)
Show SMILES [H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |r,t:20|
Show InChI InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1
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n/an/an/a 3.90n/an/an/an/an/a



TBA

Curated by ChEMBL




J Med Chem 27: 1131-7 (1984)


BindingDB Entry DOI: 10.7270/Q2W95CDM
More data for this
Ligand-Target Pair
Estrogen receptor


(RAT-Rattus norvegicus)
BDBM50225310
PNG
(CHEMBL1794824)
Show SMILES [H][C@](O)(C#C)C12CCCC1C1CCC3=CC(=O)CC[C@]3([H])C1CC2.[H][C@@](O)(C#C)C12CCCC1C1CCC3=CC(=O)CC[C@]3([H])C1CC2 |t:14,41|
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n/an/an/a 160n/an/an/an/an/a



TBA

Curated by ChEMBL




J Med Chem 27: 1131-7 (1984)


BindingDB Entry DOI: 10.7270/Q2W95CDM
More data for this
Ligand-Target Pair
Estrogen receptor


(RAT-Rattus norvegicus)
BDBM50225311
PNG
(CHEMBL15128)
Show SMILES [H][C@@]12CCC[C@@]1(CC(C)=O)CC[C@]1([H])[C@@]3([H])CCC(=O)C=C3CC[C@@]21[H] |c:21|
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n/an/an/a 220n/an/an/an/an/a



TBA

Curated by ChEMBL




J Med Chem 27: 1131-7 (1984)


BindingDB Entry DOI: 10.7270/Q2W95CDM
More data for this
Ligand-Target Pair
Estrogen receptor


(RAT-Rattus norvegicus)
BDBM50148732
PNG
(17-ethynyl-17beta-hydroxyestr-4-en-3-one | 17alpha...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C |t:8|
Show InChI InChI=1S/C20H26O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,12,15-18,22H,4-11H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1
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n/an/an/a 0.630n/an/an/an/an/a



TBA

Curated by ChEMBL




J Med Chem 27: 1131-7 (1984)


BindingDB Entry DOI: 10.7270/Q2W95CDM
More data for this
Ligand-Target Pair
Estrogen receptor


(RAT-Rattus norvegicus)
BDBM50225313
PNG
(CHEMBL273571)
Show SMILES [H][C@@]12CCC[C@]1(CC[C@]1([H])[C@@]3([H])CCC(=O)C=C3CC[C@@]21[H])C(OC(C)=O)C(C)=O |c:17|
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n/an/an/a 5.10E+3n/an/an/an/an/a



TBA

Curated by ChEMBL




J Med Chem 27: 1131-7 (1984)


BindingDB Entry DOI: 10.7270/Q2W95CDM
More data for this
Ligand-Target Pair
Estrogen receptor


(RAT-Rattus norvegicus)
BDBM50225314
PNG
(CHEMBL1627822)
Show SMILES [H][C@@]12CCC[C@@]1(CO)CC[C@]1([H])c3ccc(O)cc3CC[C@@]21[H] |r|
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n/an/an/a 0.620n/an/an/an/an/a



TBA

Curated by ChEMBL




J Med Chem 27: 1131-7 (1984)


BindingDB Entry DOI: 10.7270/Q2W95CDM
More data for this
Ligand-Target Pair
Estrogen receptor


(RAT-Rattus norvegicus)
BDBM50225312
PNG
(CHEMBL14506)
Show SMILES [H][C@@](O)(C#C)C12CCCC1C1CCC3=CC(=O)CC[C@]3([H])C1CC2 |t:14|
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n/an/an/a 730n/an/an/an/an/a



TBA

Curated by ChEMBL




J Med Chem 27: 1131-7 (1984)


BindingDB Entry DOI: 10.7270/Q2W95CDM
More data for this
Ligand-Target Pair