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Compile Data Set for Download or QSAR

Found 264 hits with Last Name = 'winn' and Initial = 'dt'   
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))
BDBM50072024
PNG
((11R,13S,14S,17S)-11-(4-Dimethylamino-phenyl)-17-h...)
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 |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+/m1/s1
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1.10n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Progesterone receptor


(Homo sapiens (Human))
BDBM50072018
PNG
(5,8-difluoro-2,2,4-trimethyl-2,10-dihydro-1H-inden...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4cc(F)ccc4-c3c(F)c12 |t:1|
Show InChI InChI=1S/C19H17F2N/c1-10-9-19(2,3)22-15-8-12-6-11-7-13(20)4-5-14(11)17(12)18(21)16(10)15/h4-5,7-9,22H,6H2,1-3H3
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1.5n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071997
PNG
(7-Fluoro-2,2,4-trimethyl-8-nitro-2,10-dihydro-1H-i...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4cc(c(F)cc4-c3cc12)[N+]([O-])=O |t:1|
Show InChI InChI=1S/C19H17FN2O2/c1-10-9-19(2,3)21-17-5-11-4-12-6-18(22(23)24)16(20)8-15(12)14(11)7-13(10)17/h5-9,21H,4H2,1-3H3
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1.90n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072007
PNG
(9-Fluoro-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4c(cccc4F)-c3cc12 |t:1|
Show InChI InChI=1S/C19H18FN/c1-11-10-19(2,3)21-18-8-12-7-16-13(5-4-6-17(16)20)15(12)9-14(11)18/h4-6,8-10,21H,7H2,1-3H3
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2.30n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072014
PNG
(6,9-difluoro-2,2,4-trimethyl-2,10-dihydro-1H-inden...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4c(-c3cc12)c(F)ccc4F |t:1|
Show InChI InChI=1S/C19H17F2N/c1-10-9-19(2,3)22-17-7-11-6-14-15(20)4-5-16(21)18(14)13(11)8-12(10)17/h4-5,7-9,22H,6H2,1-3H3
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3.10n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071990
PNG
(8-Fluoro-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4cc(F)ccc4-c3cc12 |t:1|
Show InChI InChI=1S/C19H18FN/c1-11-10-19(2,3)21-18-8-13-6-12-7-14(20)4-5-15(12)17(13)9-16(11)18/h4-5,7-10,21H,6H2,1-3H3
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3.5n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072010
PNG
(2,2,4-trimethyl-8-nitro-2,10-dihydro-1H-indeno[1,2...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4cc(ccc4-c3cc12)[N+]([O-])=O |t:1|
Show InChI InChI=1S/C19H18N2O2/c1-11-10-19(2,3)20-18-8-13-6-12-7-14(21(22)23)4-5-15(12)17(13)9-16(11)18/h4-5,7-10,20H,6H2,1-3H3
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3.60n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071995
PNG
(6-fluoro-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4cccc(F)c4-c3cc12 |t:1|
Show InChI InChI=1S/C19H18FN/c1-11-10-19(2,3)21-17-8-13-7-12-5-4-6-16(20)18(12)15(13)9-14(11)17/h4-6,8-10,21H,7H2,1-3H3
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11n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071988
PNG
((2,2,4-Trimethyl-2,10-dihydro-1H-indeno[1,2-g]quin...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4c(cccc4CO)-c3cc12 |t:1|
Show InChI InChI=1S/C20H21NO/c1-12-10-20(2,3)21-19-8-14-7-17-13(11-22)5-4-6-15(17)18(14)9-16(12)19/h4-6,8-10,21-22H,7,11H2,1-3H3
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12n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071989
PNG
(1,3,3-trimethyl-4,11-dihydro-3H-indeno[2,1-f]quino...)
Show SMILES CC1=CC(C)(C)Nc2ccc-3c(Cc4ccccc-34)c12 |t:1|
Show InChI InChI=1S/C19H19N/c1-12-11-19(2,3)20-17-9-8-15-14-7-5-4-6-13(14)10-16(15)18(12)17/h4-9,11,20H,10H2,1-3H3
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13n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072005
PNG
(2,2,4-Trimethyl-2,10-dihydro-1H-indeno[1,2-g]quino...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4ccccc4-c3cc12 |t:1|
Show InChI InChI=1S/C19H19N/c1-12-11-19(2,3)20-18-9-14-8-13-6-4-5-7-15(13)17(14)10-16(12)18/h4-7,9-11,20H,8H2,1-3H3
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14n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071986
PNG
(10-Fluoro-1,3,3-trimethyl-4,11-dihydro-3H-indeno[2...)
Show SMILES CC1=CC(C)(C)Nc2ccc-3c(Cc4c-3cccc4F)c12 |t:1|
Show InChI InChI=1S/C19H18FN/c1-11-10-19(2,3)21-17-8-7-13-12-5-4-6-16(20)14(12)9-15(13)18(11)17/h4-8,10,21H,9H2,1-3H3
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16n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071993
PNG
(6,9-Difluoro-1,3,3-trimethyl-4,11-dihydro-3H-inden...)
Show SMILES CC1=CC(C)(C)Nc2cc(F)c-3c(Cc4cc(F)ccc-34)c12 |t:1|
Show InChI InChI=1S/C19H17F2N/c1-10-9-19(2,3)22-16-8-15(21)18-13-5-4-12(20)6-11(13)7-14(18)17(10)16/h4-6,8-9,22H,7H2,1-3H3
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21n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072004
PNG
(8-bromo-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,2...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4cc(Br)ccc4-c3cc12 |t:1|
Show InChI InChI=1S/C19H18BrN/c1-11-10-19(2,3)21-18-8-13-6-12-7-14(20)4-5-15(12)17(13)9-16(11)18/h4-5,7-10,21H,6H2,1-3H3
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24n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072013
PNG
(6,8-Difluoro-2,2,4-trimethyl-2,10-dihydro-1H-inden...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(O)c4cc(F)cc(F)c4-c3cc12 |t:1|
Show InChI InChI=1S/C19H17F2NO/c1-9-8-19(2,3)22-16-7-13-12(6-11(9)16)17-14(18(13)23)4-10(20)5-15(17)21/h4-8,18,22-23H,1-3H3
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26n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072008
PNG
(8-chloro-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,...)
Show SMILES CC1=CC(C)(C)Nc2cc3Cc4cc(Cl)ccc4-c3cc12 |t:1|
Show InChI InChI=1S/C19H18ClN/c1-11-10-19(2,3)21-18-8-13-6-12-7-14(20)4-5-15(12)17(13)9-16(11)18/h4-5,7-10,21H,6H2,1-3H3
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29n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071992
PNG
(6-Fluoro-2,2,4-trimethyl-1,2-dihydro-indeno[1,2-g]...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(=O)c4cccc(F)c4-c3cc12 |t:1|
Show InChI InChI=1S/C19H16FNO/c1-10-9-19(2,3)21-16-8-14-13(7-12(10)16)17-11(18(14)22)5-4-6-15(17)20/h4-9,21H,1-3H3
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29n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072015
PNG
(5-Chloro-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(O)c4ccccc4-c3c(Cl)c12 |t:1|
Show InChI InChI=1S/C19H18ClNO/c1-10-9-19(2,3)21-14-8-13-16(17(20)15(10)14)11-6-4-5-7-12(11)18(13)22/h4-9,18,21-22H,1-3H3
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53n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071996
PNG
(1,3,3-Trimethyl-9-nitro-4,11-dihydro-3H-indeno[2,1...)
Show SMILES CC1=CC(C)(C)Nc2ccc-3c(Cc4cc(ccc-34)[N+]([O-])=O)c12 |t:1|
Show InChI InChI=1S/C19H18N2O2/c1-11-10-19(2,3)20-17-7-6-15-14-5-4-13(21(22)23)8-12(14)9-16(15)18(11)17/h4-8,10,20H,9H2,1-3H3
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57n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071999
PNG
(CHEMBL327934 | Trifluoro-acetic acid 5,8-difluoro-...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(OC(=O)C(F)(F)F)c4cc(F)ccc4-c3c(F)c12 |t:1|
Show InChI InChI=1S/C21H16F5NO2/c1-9-8-20(2,3)27-14-7-13-16(17(23)15(9)14)11-5-4-10(22)6-12(11)18(13)29-19(28)21(24,25)26/h4-8,18,27H,1-3H3
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63n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072011
PNG
(11-butyl-1,3,3-trimethyl-4,11-dihydro-3H-pyrido[3,...)
Show SMILES CCCCn1c2ccccc2c2ccc3NC(C)(C)C=C(C)c3c12 |t:20|
Show InChI InChI=1S/C22H26N2/c1-5-6-13-24-19-10-8-7-9-16(19)17-11-12-18-20(21(17)24)15(2)14-22(3,4)23-18/h7-12,14,23H,5-6,13H2,1-4H3
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77n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072016
PNG
(1,3,3-Trimethyl-3,4-dihydro-benzo[4,5]furo[2,3-f]q...)
Show SMILES CC1=CC(C)(C)Nc2ccc3c4ccccc4oc3c12 |t:1|
Show InChI InChI=1S/C18H17NO/c1-11-10-18(2,3)19-14-9-8-13-12-6-4-5-7-15(12)20-17(13)16(11)14/h4-10,19H,1-3H3
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77n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072012
PNG
(2,2,4-Trimethyl-2,3,4,10-tetrahydro-1H-indeno[1,2-...)
Show SMILES CC1CC(C)(C)Nc2cc3Cc4ccccc4-c3cc12
Show InChI InChI=1S/C19H21N/c1-12-11-19(2,3)20-18-9-14-8-13-6-4-5-7-15(13)17(14)10-16(12)18/h4-7,9-10,12,20H,8,11H2,1-3H3
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87n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071985
PNG
(8-fluoro-1,3,3-trimethyl-9-nitro-4,11-dihydro-3H-i...)
Show SMILES CC1=CC(C)(C)Nc2ccc-3c(Cc4cc(c(F)cc-34)[N+]([O-])=O)c12 |t:1|
Show InChI InChI=1S/C19H17FN2O2/c1-10-9-19(2,3)21-16-5-4-12-13-8-15(20)17(22(23)24)7-11(13)6-14(12)18(10)16/h4-5,7-9,21H,6H2,1-3H3
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97n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072000
PNG
(8-Fluoro-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(O)c4cc(F)ccc4-c3cc12 |t:1|
Show InChI InChI=1S/C19H18FNO/c1-10-9-19(2,3)21-17-8-16-14(7-13(10)17)12-5-4-11(20)6-15(12)18(16)22/h4-9,18,21-22H,1-3H3
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101n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072021
PNG
(2,2,4-Trimethyl-2,10-dihydro-1H-pyrido[2,3-b]carba...)
Show SMILES CC1=CC(C)(C)Nc2cc3[nH]c4ccccc4c3cc12 |t:1|
Show InChI InChI=1S/C18H18N2/c1-11-10-18(2,3)20-17-9-16-14(8-13(11)17)12-6-4-5-7-15(12)19-16/h4-10,19-20H,1-3H3
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113n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50066527
PNG
(2,2,4-Trimethyl-6-phenyl-1,2-dihydro-quinoline | 2...)
Show SMILES CC1=CC(C)(C)Nc2ccc(cc12)-c1ccccc1 |t:1|
Show InChI InChI=1S/C18H19N/c1-13-12-18(2,3)19-17-10-9-15(11-16(13)17)14-7-5-4-6-8-14/h4-12,19H,1-3H3
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133n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072001
PNG
(11-Ethyl-1,3,3-trimethyl-4,11-dihydro-3H-pyrido[3,...)
Show SMILES CCn1c2ccccc2c2ccc3NC(C)(C)C=C(C)c3c12 |t:18|
Show InChI InChI=1S/C20H22N2/c1-5-22-17-9-7-6-8-14(17)15-10-11-16-18(19(15)22)13(2)12-20(3,4)21-16/h6-12,21H,5H2,1-4H3
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169n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071991
PNG
(1-(2,2,4-Trimethyl-2,10-dihydro-1H-indeno[1,2-g]qu...)
Show SMILES CC(=O)c1ccc-2c(Cc3cc4NC(C)(C)C=C(C)c4cc-23)c1 |t:16|
Show InChI InChI=1S/C21H21NO/c1-12-11-21(3,4)22-20-9-16-8-15-7-14(13(2)23)5-6-17(15)19(16)10-18(12)20/h5-7,9-11,22H,8H2,1-4H3
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176n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072003
PNG
(2,2,4-Trimethyl-1,2-dihydro-benzo[4,5]furo[3,2-g]q...)
Show SMILES CC1=CC(C)(C)Nc2cc3oc4ccccc4c3cc12 |t:1|
Show InChI InChI=1S/C18H17NO/c1-11-10-18(2,3)19-15-9-17-14(8-13(11)15)12-6-4-5-7-16(12)20-17/h4-10,19H,1-3H3
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184n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072023
PNG
(9-Bromo-1,3,3-trimethyl-4,11-dihydro-3H-indeno[2,1...)
Show SMILES CC1=CC(C)(C)Nc2ccc-3c(Cc4cc(Br)ccc-34)c12 |t:1|
Show InChI InChI=1S/C19H18BrN/c1-11-10-19(2,3)21-17-7-6-15-14-5-4-13(20)8-12(14)9-16(15)18(11)17/h4-8,10,21H,9H2,1-3H3
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200n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072019
PNG
(7,9-Difluoro-2,2,4-trimethyl-2,10-dihydro-1H-inden...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(O)c4c(cc(F)cc4F)-c3cc12 |t:1|
Show InChI InChI=1S/C19H17F2NO/c1-9-8-19(2,3)22-16-7-14-12(6-11(9)16)13-4-10(20)5-15(21)17(13)18(14)23/h4-8,18,22-23H,1-3H3
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202n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072006
PNG
(6-Fluoro-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(O)c4cccc(F)c4-c3cc12 |t:1|
Show InChI InChI=1S/C19H18FNO/c1-10-9-19(2,3)21-16-8-14-13(7-12(10)16)17-11(18(14)22)5-4-6-15(17)20/h4-9,18,21-22H,1-3H3
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449n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072002
PNG
(2,2,4-Trimethyl-2,10-dihydro-1H-indeno[1,2-g]quino...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(O)c4ccccc4-c3cc12 |t:1|
Show InChI InChI=1S/C19H19NO/c1-11-10-19(2,3)20-17-9-16-15(8-14(11)17)12-6-4-5-7-13(12)18(16)21/h4-10,18,20-21H,1-3H3
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483n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071998
PNG
(1,3,3-Trimethyl-4,11-dihydro-3H-pyrido[3,2-a]carba...)
Show SMILES CC1=CC(C)(C)Nc2ccc3c4ccccc4[nH]c3c12 |t:1|
Show InChI InChI=1S/C18H18N2/c1-11-10-18(2,3)20-15-9-8-13-12-6-4-5-7-14(12)19-17(13)16(11)15/h4-10,19-20H,1-3H3
PDB

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



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071994
PNG
(8-Bromo-2,2,4-trimethyl-2,10-dihydro-1H-indeno[1,2...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(O)c4cc(Br)ccc4-c3cc12 |t:1|
Show InChI InChI=1S/C19H18BrNO/c1-10-9-19(2,3)21-17-8-16-14(7-13(10)17)12-5-4-11(20)6-15(12)18(16)22/h4-9,18,21-22H,1-3H3
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1.86E+3n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072020
PNG
(6,9-Difluoro-1,3,3-trimethyl-4,11-dihydro-3H-inden...)
Show SMILES CC1=CC(C)(C)Nc2cc(F)c3-c4ccc(F)cc4C(O)c3c12 |t:1|
Show InChI InChI=1S/C19H17F2NO/c1-9-8-19(2,3)22-14-7-13(21)16-11-5-4-10(20)6-12(11)18(23)17(16)15(9)14/h4-8,18,22-23H,1-3H3
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2.58E+3n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072022
PNG
(2,2,4-Trimethyl-1,2-dihydro-indeno[1,2-g]quinolin-...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(=O)c4ccccc4-c3cc12 |t:1|
Show InChI InChI=1S/C19H17NO/c1-11-10-19(2,3)20-17-9-16-15(8-14(11)17)12-6-4-5-7-13(12)18(16)21/h4-10,20H,1-3H3
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3.55E+3n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072009
PNG
(8-Bromo-2,2,4,10-tetramethyl-2,10-dihydro-1H-inden...)
Show SMILES CC1c2cc(Br)ccc2-c2cc3C(C)=CC(C)(C)Nc3cc12 |c:14|
Show InChI InChI=1S/C20H20BrN/c1-11-10-20(3,4)22-19-9-17-12(2)16-7-13(21)5-6-14(16)18(17)8-15(11)19/h5-10,12,22H,1-4H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072025
PNG
(5,8-Difluoro-2,2,4-trimethyl-1,2-dihydro-indeno[1,...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(=O)c4cc(F)ccc4-c3c(F)c12 |t:1|
Show InChI InChI=1S/C19H15F2NO/c1-9-8-19(2,3)22-14-7-13-16(17(21)15(9)14)11-5-4-10(20)6-12(11)18(13)23/h4-8,22H,1-3H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50071987
PNG
(10-Benzyl-8-bromo-2,2,4-trimethyl-2,10-dihydro-1H-...)
Show SMILES CC1=CC(C)(C)Nc2cc3C(Cc4ccccc4)c4cc(Br)ccc4-c3cc12 |t:1|
Show InChI InChI=1S/C26H24BrN/c1-16-15-26(2,3)28-25-14-24-21(11-17-7-5-4-6-8-17)22-12-18(27)9-10-19(22)23(24)13-20(16)25/h4-10,12-15,21,28H,11H2,1-3H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072017
PNG
(5,8-Difluoro-2,2,4,10-tetramethyl-2,10-dihydro-1H-...)
Show SMILES CC1=CC(C)(C)Nc2cc3c(-c4ccc(F)cc4C3(C)O)c(F)c12 |t:1|
Show InChI InChI=1S/C20H19F2NO/c1-10-9-19(2,3)23-15-8-14-17(18(22)16(10)15)12-6-5-11(21)7-13(12)20(14,4)24/h5-9,23-24H,1-4H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against human progesterone receptor-A (hPR-A)


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
Androgen Receptor


(Homo sapiens (Human))
BDBM50403728
PNG
(CHEMBL2112312)
Show SMILES CC[C@H]1[C@H](C)CNc2cc3oc(=O)cc(c3cc12)C(F)(F)F |r|
Show InChI InChI=1S/C16H16F3NO2/c1-3-9-8(2)7-20-13-6-14-11(4-10(9)13)12(16(17,18)19)5-15(21)22-14/h4-6,8-9,20H,3,7H2,1-2H3/t8-,9+/m1/s1
PDB
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n/an/a 0.300n/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro agonistic activity against human androgen receptor using cotransfection assay in CV-1 cells.


Bioorg Med Chem Lett 9: 1003-8 (1999)


BindingDB Entry DOI: 10.7270/Q2JS9PM8
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50171552
PNG
((S)-2-(S)-Amino-1-(2-boron-dihydroxide-pyrrolidine...)
Show SMILES CC(C)[C@H](N)C(=O)N1CCC[C@@H]1B(O)O
Show InChI InChI=1S/C9H19BN2O3/c1-6(2)8(11)9(13)12-5-3-4-7(12)10(14)15/h6-8,14-15H,3-5,11H2,1-2H3/t7-,8+/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



ActivX Biosciences

Curated by ChEMBL


Assay Description
Inhibitory concentration against human dipeptidylpeptidase 4


Bioorg Med Chem Lett 15: 4256-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.076
BindingDB Entry DOI: 10.7270/Q2RR1XSW
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50072024
PNG
((11R,13S,14S,17S)-11-(4-Dimethylamino-phenyl)-17-h...)
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 |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+/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity against human progesterone receptor B (hPR-B) in cotransfected CV-1 cells


Bioorg Med Chem Lett 8: 2731-6 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S1M
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50171546
PNG
((S)-2,4-Diamino-N-((R)-1-boron-dihydroxide-pentyl)...)
Show SMILES CCCC[C@@H](NC(=O)[C@@H](N)CCN)B(O)O
Show InChI InChI=1S/C9H22BN3O3/c1-2-3-4-8(10(15)16)13-9(14)7(12)5-6-11/h7-8,15-16H,2-6,11-12H2,1H3,(H,13,14)/t7-,8+/m0/s1
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ActivX Biosciences

Curated by ChEMBL


Assay Description
Inhibitory concentration against human dipeptidylpeptidase 7


Bioorg Med Chem Lett 15: 4256-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.076
BindingDB Entry DOI: 10.7270/Q2RR1XSW
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50171555
PNG
((S)-2,4-Diamino-1-(2-boron-dihydroxide-pyrrolidin-...)
Show SMILES NCC[C@H](N)C(=O)N1CCC[C@@H]1B(O)O
Show InChI InChI=1S/C8H18BN3O3/c10-4-3-6(11)8(13)12-5-1-2-7(12)9(14)15/h6-7,14-15H,1-5,10-11H2/t6-,7+/m0/s1
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n/an/a 0.720n/an/an/an/an/an/a



ActivX Biosciences

Curated by ChEMBL


Assay Description
Inhibitory concentration against human dipeptidylpeptidase 7


Bioorg Med Chem Lett 15: 4256-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.076
BindingDB Entry DOI: 10.7270/Q2RR1XSW
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50171556
PNG
((R)-1-((S)-2-amino-3-methylbutanamido)ethylboronic...)
Show SMILES CC(C)[C@H](N)C(=O)N[C@@H](C)B(O)O |r|
Show InChI InChI=1S/C7H17BN2O3/c1-4(2)6(9)7(11)10-5(3)8(12)13/h4-6,12-13H,9H2,1-3H3,(H,10,11)/t5-,6-/m0/s1
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n/an/a 0.890n/an/an/an/an/an/a



ActivX Biosciences

Curated by ChEMBL


Assay Description
Inhibitory concentration against human dipeptidylpeptidase 4


Bioorg Med Chem Lett 15: 4256-60 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.076
BindingDB Entry DOI: 10.7270/Q2RR1XSW
More data for this
Ligand-Target Pair
Androgen Receptor


(Homo sapiens (Human))
BDBM50076688
PNG
(CHEMBL266473 | trans-7-Ethyl-4-trifluoromethyl-5,6...)
Show SMILES CCC1CCc2cc3c(cc(=O)oc3cc2N1)C(F)(F)F
Show InChI InChI=1S/C15H14F3NO2/c1-2-9-4-3-8-5-10-11(15(16,17)18)6-14(20)21-13(10)7-12(8)19-9/h5-7,9,19H,2-4H2,1H3
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n/an/a 1n/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro binding affinity at human androgen receptor transfected into COS cells.


Bioorg Med Chem Lett 9: 1003-8 (1999)


BindingDB Entry DOI: 10.7270/Q2JS9PM8
More data for this
Ligand-Target Pair
Androgen Receptor


(Homo sapiens (Human))
BDBM50076693
PNG
(5-Ethyl-4-trifluoromethyl-5,6,7,8-tetrahydro-1-oxa...)
Show SMILES CCC1CCNc2cc3oc(=O)cc(c3cc12)C(F)(F)F
Show InChI InChI=1S/C15H14F3NO2/c1-2-8-3-4-19-12-7-13-10(5-9(8)12)11(15(16,17)18)6-14(20)21-13/h5-8,19H,2-4H2,1H3
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Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro binding affinity at human androgen receptor transfected into COS cells.


Bioorg Med Chem Lett 9: 1003-8 (1999)


BindingDB Entry DOI: 10.7270/Q2JS9PM8
More data for this
Ligand-Target Pair
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