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Compile Data Set for Download or QSAR

Found 46 hits Enz. Inhib. hit(s) with all data for assayid = 17 entry = 50039191   
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))
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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Article
PubMed
5.10n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321197
PNG
(CHEMBL1163480 | rac-3-(4-Nitrophenylamino)-1-(4-ch...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(Cl)cc2)C2CCCCC2)cc1
Show InChI InChI=1S/C21H23ClN2O3/c22-17-8-6-16(7-9-17)21(25)14-20(15-4-2-1-3-5-15)23-18-10-12-19(13-11-18)24(26)27/h6-13,15,20,23H,1-5,14H2
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6.70n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321198
PNG
(CHEMBL1163481 | rac-3-(4-Nitrophenylamino)-3-cyclo...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(F)cc2)C2CCCCC2)cc1
Show InChI InChI=1S/C21H23FN2O3/c22-17-8-6-16(7-9-17)21(25)14-20(15-4-2-1-3-5-15)23-18-10-12-19(13-11-18)24(26)27/h6-13,15,20,23H,1-5,14H2
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8.5n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321199
PNG
(CHEMBL1163485 | rac-3-(4-Nitrophenylamino)-3-cyclo...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2cccc(F)c2)C2CCCCC2)cc1
Show InChI InChI=1S/C21H23FN2O3/c22-17-8-4-7-16(13-17)21(25)14-20(15-5-2-1-3-6-15)23-18-9-11-19(12-10-18)24(26)27/h4,7-13,15,20,23H,1-3,5-6,14H2
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8.5n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321211
PNG
(CHEMBL1163529 | rac-3-(4-Nitrophenylamino)-1-(3,4-...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(Cl)c(Cl)c2)C2CCCCC2)cc1
Show InChI InChI=1S/C21H22Cl2N2O3/c22-18-11-6-15(12-19(18)23)21(26)13-20(14-4-2-1-3-5-14)24-16-7-9-17(10-8-16)25(27)28/h6-12,14,20,24H,1-5,13H2
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9.10n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321196
PNG
(CHEMBL1164752 | rac-3-(4-Nitrophenylamino)-1-(4-br...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(Br)cc2)C2CCCCC2)cc1
Show InChI InChI=1S/C21H23BrN2O3/c22-17-8-6-16(7-9-17)21(25)14-20(15-4-2-1-3-5-15)23-18-10-12-19(13-11-18)24(26)27/h6-13,15,20,23H,1-5,14H2
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10.2n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321182
PNG
(CHEMBL1165483 | rac-3-(4-Nitrophenylamino)-3-cyclo...)
Show SMILES COc1ccc(cc1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)C1CCCCC1
Show InChI InChI=1S/C22H26N2O4/c1-28-20-13-7-17(8-14-20)22(25)15-21(16-5-3-2-4-6-16)23-18-9-11-19(12-10-18)24(26)27/h7-14,16,21,23H,2-6,15H2,1H3
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10.8n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321200
PNG
(CHEMBL1163484 | rac-3-(4-Nitrophenylamino)-3-cyclo...)
Show SMILES COc1cccc(c1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)C1CCCCC1
Show InChI InChI=1S/C22H26N2O4/c1-28-20-9-5-8-17(14-20)22(25)15-21(16-6-3-2-4-7-16)23-18-10-12-19(13-11-18)24(26)27/h5,8-14,16,21,23H,2-4,6-7,15H2,1H3
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11.2n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321195
PNG
(CHEMBL1164858 | rac-3-(4-Nitrophenylamino)-3-cyclo...)
Show SMILES Cc1ccc(cc1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)C1CCCCC1
Show InChI InChI=1S/C22H26N2O3/c1-16-7-9-18(10-8-16)22(25)15-21(17-5-3-2-4-6-17)23-19-11-13-20(14-12-19)24(26)27/h7-14,17,21,23H,2-6,15H2,1H3
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13n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321212
PNG
(CHEMBL1165353 | rac-3-(4-Nitrophenylamino)-3-cyclo...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccccc2)C2CCCCC2)cc1
Show InChI InChI=1S/C21H24N2O3/c24-21(17-9-5-2-6-10-17)15-20(16-7-3-1-4-8-16)22-18-11-13-19(14-12-18)23(25)26/h2,5-6,9-14,16,20,22H,1,3-4,7-8,15H2
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13n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321180
PNG
(CHEMBL1163899 | rac-3-(4-Nitrophenylamino)-3-(4-(t...)
Show SMILES COc1ccc(cc1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H19F3N2O4/c1-32-20-12-4-16(5-13-20)22(29)14-21(15-2-6-17(7-3-15)23(24,25)26)27-18-8-10-19(11-9-18)28(30)31/h2-13,21,27H,14H2,1H3
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18n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321177
PNG
(CHEMBL1163597 | rac-3-(4-Nitrophenylamino)-1-(3-ch...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2cccc(Cl)c2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C21H16ClFN2O3/c22-16-5-1-4-15(11-16)21(26)13-20(14-3-2-6-17(23)12-14)24-18-7-9-19(10-8-18)25(27)28/h1-12,20,24H,13H2
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23n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321213
PNG
(CHEMBL1164248 | rac-3-(4-Nitrophenylamino)-1-(4-ph...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(cc2)-c2ccccc2)C2CCCCC2)cc1
Show InChI InChI=1S/C27H28N2O3/c30-27(23-13-11-21(12-14-23)20-7-3-1-4-8-20)19-26(22-9-5-2-6-10-22)28-24-15-17-25(18-16-24)29(31)32/h1,3-4,7-8,11-18,22,26,28H,2,5-6,9-10,19H2
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28n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321179
PNG
(CHEMBL1163898 | rac-3-(4-Nitrophenylamino)-3-(4-(t...)
Show SMILES COc1cccc(c1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H19F3N2O4/c1-32-20-4-2-3-16(13-20)22(29)14-21(15-5-7-17(8-6-15)23(24,25)26)27-18-9-11-19(12-10-18)28(30)31/h2-13,21,27H,14H2,1H3
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31n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321208
PNG
(CHEMBL1163976 | rac-3-(4-Nitrophenylamino)-3-(3-fl...)
Show SMILES Cc1cccc(c1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)c1cccc(F)c1
Show InChI InChI=1S/C22H19FN2O3/c1-15-4-2-6-17(12-15)22(26)14-21(16-5-3-7-18(23)13-16)24-19-8-10-20(11-9-19)25(27)28/h2-13,21,24H,14H2,1H3
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35n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321220
PNG
((-)-R-3-(4-Nitrophenylamino)-3-(3-fluorophenyl)-1-...)
Show SMILES Cc1ccc(cc1)C(=O)C[C@@H](Nc1ccc(cc1)[N+]([O-])=O)c1cccc(F)c1 |r|
Show InChI InChI=1S/C22H19FN2O3/c1-15-5-7-16(8-6-15)22(26)14-21(17-3-2-4-18(23)13-17)24-19-9-11-20(12-10-19)25(27)28/h2-13,21,24H,14H2,1H3/t21-/m1/s1
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35n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321210
PNG
(CHEMBL1163645 | rac-3-(4-Nitrophenylamino)-1-(3-br...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2cccc(Br)c2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C21H16BrFN2O3/c22-16-5-1-4-15(11-16)21(26)13-20(14-3-2-6-17(23)12-14)24-18-7-9-19(10-8-18)25(27)28/h1-12,20,24H,13H2
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36n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321185
PNG
(CHEMBL1163747 | rac-3-(4-Nitrophenylamino)-1-(4-br...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(Br)cc2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C21H16BrFN2O3/c22-16-6-4-14(5-7-16)21(26)13-20(15-2-1-3-17(23)12-15)24-18-8-10-19(11-9-18)25(27)28/h1-12,20,24H,13H2
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39n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321184
PNG
(CHEMBL1163746 | rac-3-(4-Nitrophenylamino)-1-(4-ch...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(Cl)cc2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C21H16ClFN2O3/c22-16-6-4-14(5-7-16)21(26)13-20(15-2-1-3-17(23)12-15)24-18-8-10-19(11-9-18)25(27)28/h1-12,20,24H,13H2
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43n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321209
PNG
(CHEMBL1164485 | rac-3-(4-Nitrophenylamino)-1,3-bis...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2cccc(F)c2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C21H16F2N2O3/c22-16-5-1-3-14(11-16)20(13-21(26)15-4-2-6-17(23)12-15)24-18-7-9-19(10-8-18)25(27)28/h1-12,20,24H,13H2
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46n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321191
PNG
(CHEMBL1163625 | rac-3-(4-Nitrophenylamino)-3-(4-(t...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2cccc(F)c2)c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C22H16F4N2O3/c23-17-3-1-2-15(12-17)21(29)13-20(14-4-6-16(7-5-14)22(24,25)26)27-18-8-10-19(11-9-18)28(30)31/h1-12,20,27H,13H2
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47n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321183
PNG
(CHEMBL1163646 | rac-3-(4-Nitrophenylamino)-3-(3-fl...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccccc2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C21H17FN2O3/c22-17-8-4-7-16(13-17)20(14-21(25)15-5-2-1-3-6-15)23-18-9-11-19(12-10-18)24(26)27/h1-13,20,23H,14H2
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49n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321186
PNG
(CHEMBL1165642 | rac-3-(4-Nitrophenylamino)-1-(4-ph...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(cc2)-c2ccccc2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C27H21FN2O3/c28-23-8-4-7-22(17-23)26(29-24-13-15-25(16-14-24)30(32)33)18-27(31)21-11-9-20(10-12-21)19-5-2-1-3-6-19/h1-17,26,29H,18H2
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50n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321214
PNG
(CHEMBL1164338 | rac-3-(4-Nitrophenylamino)-3-cyclo...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(cc2)C2CCCCC2)C2CCCCC2)cc1
Show InChI InChI=1S/C27H34N2O3/c30-27(23-13-11-21(12-14-23)20-7-3-1-4-8-20)19-26(22-9-5-2-6-10-22)28-24-15-17-25(18-16-24)29(31)32/h11-18,20,22,26,28H,1-10,19H2
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51n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321176
PNG
(CHEMBL1163598 | rac-3-(4-Nitrophenylamino)-3-(3-fl...)
Show SMILES Cc1ccc(cc1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)c1cccc(F)c1
Show InChI InChI=1S/C22H19FN2O3/c1-15-5-7-16(8-6-15)22(26)14-21(17-3-2-4-18(23)13-17)24-19-9-11-20(12-10-19)25(27)28/h2-13,21,24H,14H2,1H3
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54n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321193
PNG
(CHEMBL1163822 | rac-3-(4-Nitrophenylamino)-1-(3-cy...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2cccc(c2)C#N)c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C23H16F3N3O3/c24-23(25,26)18-6-4-16(5-7-18)21(28-19-8-10-20(11-9-19)29(31)32)13-22(30)17-3-1-2-15(12-17)14-27/h1-12,21,28H,13H2
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56n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321189
PNG
(CHEMBL1163717 | rac-3-(4-Nitrophenylamino)-1-(3-ch...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2cccc(Cl)c2)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C21H16ClFN2O3/c22-16-3-1-2-15(12-16)21(26)13-20(14-4-6-17(23)7-5-14)24-18-8-10-19(11-9-18)25(27)28/h1-12,20,24H,13H2
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58n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321203
PNG
(CHEMBL1163604 | rac-3-(4-Nitrophenylamino)-3-pheny...)
Show SMILES Cc1ccc(cc1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)c1ccccc1
Show InChI InChI=1S/C22H20N2O3/c1-16-7-9-18(10-8-16)22(25)15-21(17-5-3-2-4-6-17)23-19-11-13-20(14-12-19)24(26)27/h2-14,21,23H,15H2,1H3
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66n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321181
PNG
(CHEMBL1164857 | rac-3-(4-Nitrophenylamino)-1-(4-br...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(Br)cc2)c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C22H16BrF3N2O3/c23-17-7-3-15(4-8-17)21(29)13-20(14-1-5-16(6-2-14)22(24,25)26)27-18-9-11-19(12-10-18)28(30)31/h1-12,20,27H,13H2
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66n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321178
PNG
(CHEMBL1163644 | rac-3-(4-Nitrophenylamino)-3-(3-fl...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(F)cc2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C21H16F2N2O3/c22-16-6-4-14(5-7-16)21(26)13-20(15-2-1-3-17(23)12-15)24-18-8-10-19(11-9-18)25(27)28/h1-12,20,24H,13H2
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68n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321202
PNG
(CHEMBL1163602 | rac-3-(4-Nitrophenylamino)-1-(4-cy...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(cc2)C#N)c2ccsc2)cc1
Show InChI InChI=1S/C20H15N3O3S/c21-12-14-1-3-15(4-2-14)20(24)11-19(16-9-10-27-13-16)22-17-5-7-18(8-6-17)23(25)26/h1-10,13,19,22H,11H2
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75n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321187
PNG
(CHEMBL1163902 | rac-3-(4-Nitrophenylamino)-1-(4-cy...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(cc2)C2CCCCC2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C27H27FN2O3/c28-23-8-4-7-22(17-23)26(29-24-13-15-25(16-14-24)30(32)33)18-27(31)21-11-9-20(10-12-21)19-5-2-1-3-6-19/h4,7-17,19,26,29H,1-3,5-6,18H2
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76n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321188
PNG
(CHEMBL1163620 | rac-3-(4-Nitrophenylamino)-3-(3-fl...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(cc2)N2CCOCC2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C25H24FN3O4/c26-20-3-1-2-19(16-20)24(27-21-6-10-23(11-7-21)29(31)32)17-25(30)18-4-8-22(9-5-18)28-12-14-33-15-13-28/h1-11,16,24,27H,12-15,17H2
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78n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321194
PNG
(CHEMBL1164856 | rac-3-(4-Nitrophenylamino)-1-(4-ch...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2ccc(Cl)cc2)c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C22H16ClF3N2O3/c23-17-7-3-15(4-8-17)21(29)13-20(14-1-5-16(6-2-14)22(24,25)26)27-18-9-11-19(12-10-18)28(30)31/h1-12,20,27H,13H2
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80n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321221
PNG
((+)-(S)-3-(4-Nitrophenylamino)-3-(3-fluorophenyl)-...)
Show SMILES Cc1ccc(cc1)C(=O)C[C@H](Nc1ccc(cc1)[N+]([O-])=O)c1cccc(F)c1 |r|
Show InChI InChI=1S/C22H19FN2O3/c1-15-5-7-16(8-6-15)22(26)14-21(17-3-2-4-18(23)13-17)24-19-9-11-20(12-10-19)25(27)28/h2-13,21,24H,14H2,1H3/t21-/m0/s1
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84n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321192
PNG
(CHEMBL1163812 | rac-3-(4-Nitrophenylamino)-3-(4-(t...)
Show SMILES Cc1cccc(c1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H19F3N2O3/c1-15-3-2-4-17(13-15)22(29)14-21(16-5-7-18(8-6-16)23(24,25)26)27-19-9-11-20(12-10-19)28(30)31/h2-13,21,27H,14H2,1H3
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85n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321190
PNG
(CHEMBL1163617 | rac-3-(4-Nitrophenylamino)-1-(3-ch...)
Show SMILES [O-][N+](=O)c1ccc(NC(CC(=O)c2cccc(Cl)c2)c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C22H16ClF3N2O3/c23-17-3-1-2-15(12-17)21(29)13-20(14-4-6-16(7-5-14)22(24,25)26)27-18-8-10-19(11-9-18)28(30)31/h1-12,20,27H,13H2
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87n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321215
PNG
(CHEMBL1164339 | rac-3-(3-Nitrophenylamino)-3-(3-fl...)
Show SMILES Cc1ccc(cc1)C(=O)CC(Nc1cccc(c1)[N+]([O-])=O)c1cccc(F)c1
Show InChI InChI=1S/C22H19FN2O3/c1-15-8-10-16(11-9-15)22(26)14-21(17-4-2-5-18(23)12-17)24-19-6-3-7-20(13-19)25(27)28/h2-13,21,24H,14H2,1H3
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99n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321201
PNG
(CHEMBL1164379 | rac-3-(4-Nitrophenylamino)-3-(thio...)
Show SMILES Cc1ccc(cc1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)c1ccsc1
Show InChI InChI=1S/C20H18N2O3S/c1-14-2-4-15(5-3-14)20(23)12-19(16-10-11-26-13-16)21-17-6-8-18(9-7-17)22(24)25/h2-11,13,19,21H,12H2,1H3
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103n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321207
PNG
(CHEMBL1165799 | rac-3-(4-Nitrophenylamino)-1-(3-fl...)
Show SMILES COc1cc(cc(OC)c1OC)C(CC(=O)c1cccc(F)c1)Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C24H23FN2O6/c1-31-22-12-16(13-23(32-2)24(22)33-3)20(14-21(28)15-5-4-6-17(25)11-15)26-18-7-9-19(10-8-18)27(29)30/h4-13,20,26H,14H2,1-3H3
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121n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321206
PNG
(CHEMBL1163975 | rac-3-(4-Nitrophenylamino)-3-(3,4,...)
Show SMILES COc1cc(cc(OC)c1OC)C(CC(=O)c1cccc(C)c1)Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C25H26N2O6/c1-16-6-5-7-17(12-16)22(28)15-21(26-19-8-10-20(11-9-19)27(29)30)18-13-23(31-2)25(33-4)24(14-18)32-3/h5-14,21,26H,15H2,1-4H3
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173n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321205
PNG
(CHEMBL1163643 | rac-3-(4-Nitrophenylamino)-3-(3,4,...)
Show SMILES COc1cc(cc(OC)c1OC)C(CC(=O)c1ccc(C)cc1)Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C25H26N2O6/c1-16-5-7-17(8-6-16)22(28)15-21(26-19-9-11-20(12-10-19)27(29)30)18-13-23(31-2)25(33-4)24(14-18)32-3/h5-14,21,26H,15H2,1-4H3
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236n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321217
PNG
(CHEMBL1163588 | rac-3-(4-Fluorophenylamino)-3-(3-f...)
Show SMILES Cc1ccc(cc1)C(=O)CC(Nc1ccc(F)cc1)c1cccc(F)c1
Show InChI InChI=1S/C22H19F2NO/c1-15-5-7-16(8-6-15)22(26)14-21(17-3-2-4-19(24)13-17)25-20-11-9-18(23)10-12-20/h2-13,21,25H,14H2,1H3
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444n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321218
PNG
(CHEMBL1163585 | rac-3-(3,4-Difluorophenylamino)-3-...)
Show SMILES Cc1ccc(cc1)C(=O)CC(Nc1ccc(F)c(F)c1)c1cccc(F)c1
Show InChI InChI=1S/C22H18F3NO/c1-14-5-7-15(8-6-14)22(27)13-21(16-3-2-4-17(23)11-16)26-18-9-10-19(24)20(25)12-18/h2-12,21,26H,13H2,1H3
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574n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321204
PNG
(CHEMBL1163595 | rac-3-(4-Methoxyphenylamino)-3-phe...)
Show SMILES COc1ccc(NC(CC(=O)c2ccc(C)cc2)c2ccccc2)cc1
Show InChI InChI=1S/C23H23NO2/c1-17-8-10-19(11-9-17)23(25)16-22(18-6-4-3-5-7-18)24-20-12-14-21(26-2)15-13-20/h3-15,22,24H,16H2,1-2H3
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1.12E+3n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50321216
PNG
(CHEMBL1163581 | rac-3-(4-(Trifluoromethyl)phenylam...)
Show SMILES Cc1ccc(cc1)C(=O)CC(Nc1ccc(cc1)C(F)(F)F)c1cccc(F)c1
Show InChI InChI=1S/C23H19F4NO/c1-15-5-7-16(8-6-15)22(29)14-21(17-3-2-4-19(24)13-17)28-20-11-9-18(10-12-20)23(25,26)27/h2-13,21,28H,14H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]progesterone from human progesterone receptor B after 16 hrs by scintillation counting


Bioorg Med Chem 18: 4255-68 (2010)


Article DOI: 10.1016/j.bmc.2010.04.092
BindingDB Entry DOI: 10.7270/Q2QN67RQ
More data for this
Ligand-Target Pair