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Patent code US9789116

Compile Data Set for Download or QSAR
Found 96 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
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347364
PNG
(US9789116, SW206980)
Show SMILES CCCCS(=O)c1sc2nc(ccc2c1N)-c1cccs1
Show InChI InChI=1S/C15H16N2OS3/c1-2-3-9-21(18)15-13(16)10-6-7-11(17-14(10)20-15)12-5-4-8-19-12/h4-8H,2-3,9,16H2,1H3
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n/an/a 0.970n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347384
PNG
(US9789116, SW208436)
Show SMILES CCCCS(=O)c1sc2nc(nc(-c3ccccc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C19H18N4OS3/c1-2-3-11-27(24)19-14(20)13-15(12-7-5-4-6-8-12)22-16(23-17(13)26-19)18-21-9-10-25-18/h4-10H,2-3,11,20H2,1H3
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n/an/a 1.14n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347429
PNG
(US9789116, SW209415)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cnc(C)n3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C19H21N5OS3/c1-4-5-8-28(25)19-16(20)15-12(14-10-22-11(2)24(14)3)9-13(23-18(15)27-19)17-21-6-7-26-17/h6-7,9-10H,4-5,8,20H2,1-3H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347429
PNG
(US9789116, SW209415)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cnc(C)n3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C19H21N5OS3/c1-4-5-8-28(25)19-16(20)15-12(14-10-22-11(2)24(14)3)9-13(23-18(15)27-19)17-21-6-7-26-17/h6-7,9-10H,4-5,8,20H2,1-3H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347379
PNG
(US9789116, SW211668)
Show SMILES CCCC[S@@+]([O-])c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H20N2OS3/c1-2-3-12-27(24)21-19(22)18-15(14-8-5-4-6-9-14)13-16(23-20(18)26-21)17-10-7-11-25-17/h4-11,13H,2-3,12,22H2,1H3/t27-/m1/s1
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n/an/a 1.34n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347391
PNG
(US9789116, SW208496)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1ncco1
Show InChI InChI=1S/C20H19N3O2S2/c1-2-3-11-27(24)20-17(21)16-14(13-7-5-4-6-8-13)12-15(23-19(16)26-20)18-22-9-10-25-18/h4-10,12H,2-3,11,21H2,1H3
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n/an/a 1.37n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347368
PNG
(US9789116, SW208066)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C20H19N3OS3/c1-2-3-11-27(24)20-17(21)16-14(13-7-5-4-6-8-13)12-15(23-19(16)26-20)18-22-9-10-25-18/h4-10,12H,2-3,11,21H2,1H3
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n/an/a 1.37n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347365
PNG
(US9789116, SW206992)
Show SMILES CCCCS(=O)c1sc2nc(ccc2c1N)-c1nccs1
Show InChI InChI=1S/C14H15N3OS3/c1-2-3-8-21(18)14-11(15)9-4-5-10(17-12(9)20-14)13-16-6-7-19-13/h4-7H,2-3,8,15H2,1H3
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n/an/a 1.41n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347388
PNG
(US9789116, SW208488)
Show SMILES CCCCS(=O)c1sc2nc(cc(C)c2c1N)-c1cccs1
Show InChI InChI=1S/C16H18N2OS3/c1-3-4-8-22(19)16-14(17)13-10(2)9-11(18-15(13)21-16)12-6-5-7-20-12/h5-7,9H,3-4,8,17H2,1-2H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347405
PNG
(US9789116, SW209124)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3nccs3)c2c1N)-c1nccs1
Show InChI InChI=1S/C17H16N4OS4/c1-2-3-8-26(22)17-13(18)12-10(14-19-4-6-23-14)9-11(21-16(12)25-17)15-20-5-7-24-15/h4-7,9H,2-3,8,18H2,1H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347402
PNG
(US9789116, SW208781)
Show SMILES CCCS(=O)c1sc2nc(cc(C(=O)OCC)c2c1N)-c1cccs1
Show InChI InChI=1S/C17H18N2O3S3/c1-3-8-25(21)17-14(18)13-10(16(20)22-4-2)9-11(19-15(13)24-17)12-6-5-7-23-12/h5-7,9H,3-4,8,18H2,1-2H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347386
PNG
(US9789116, SW208437)
Show SMILES CCCS(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C20H18N2OS3/c1-2-11-26(23)20-18(21)17-14(13-7-4-3-5-8-13)12-15(22-19(17)25-20)16-9-6-10-24-16/h3-10,12H,2,11,21H2,1H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347416
PNG
(US9789116, SW209276)
Show SMILES COCCC[S+]([O-])c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H20N2O2S3/c1-25-10-6-12-28(24)21-19(22)18-15(14-7-3-2-4-8-14)13-16(23-20(18)27-21)17-9-5-11-26-17/h2-5,7-9,11,13H,6,10,12,22H2,1H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347406
PNG
(US9789116, SW209125)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3nccn3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C18H19N5OS3/c1-3-4-9-27(24)18-14(19)13-11(15-20-5-7-23(15)2)10-12(22-17(13)26-18)16-21-6-8-25-16/h5-8,10H,3-4,9,19H2,1-2H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347436
PNG
(US9789116, SW209428)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cnc(C)[nH]3)c2c1N)-c1nccs1
Show InChI InChI=1S/C18H19N5OS3/c1-3-4-7-27(24)18-15(19)14-11(13-9-21-10(2)22-13)8-12(23-17(14)26-18)16-20-5-6-25-16/h5-6,8-9H,3-4,7,19H2,1-2H3,(H,21,22)
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347369
PNG
(US9789116, SW208067)
Show SMILES CCCCS(=O)c1sc2nc(nc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C20H19N3OS3/c1-2-3-12-27(24)20-16(21)15-17(13-8-5-4-6-9-13)22-18(23-19(15)26-20)14-10-7-11-25-14/h4-11H,2-3,12,21H2,1H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347439
PNG
(US9789116, SW209510)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(CO)cc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C21H21N3O2S3/c1-2-3-10-29(26)21-18(22)17-15(14-6-4-13(12-25)5-7-14)11-16(24-20(17)28-21)19-23-8-9-27-19/h4-9,11,25H,2-3,10,12,22H2,1H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347440
PNG
(US9789116, SW209511)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(COC(C)=O)cc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C23H23N3O3S3/c1-3-4-11-32(28)23-20(24)19-17(16-7-5-15(6-8-16)13-29-14(2)27)12-18(26-22(19)31-23)21-25-9-10-30-21/h5-10,12H,3-4,11,13,24H2,1-2H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347437
PNG
(US9789116, SW209508)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cccc(c3)C(=O)NCC=C)c2c1N)-c1nccs1
Show InChI InChI=1S/C24H24N4O2S3/c1-3-5-12-33(30)24-20(25)19-17(14-18(28-23(19)32-24)22-27-10-11-31-22)15-7-6-8-16(13-15)21(29)26-9-4-2/h4,6-8,10-11,13-14H,2-3,5,9,12,25H2,1H3,(H,26,29)
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347359
PNG
(US9789116, SW033291)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H20N2OS3/c1-2-3-12-27(24)21-19(22)18-15(14-8-5-4-6-9-14)13-16(23-20(18)26-21)17-10-7-11-25-17/h4-11,13H,2-3,12,22H2,1H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347418
PNG
(US9789116, SW209278)
Show SMILES CCCCS(=O)c1sc2nc(nc(-c3ccccc3)c2c1N)-c1cocn1
Show InChI InChI=1S/C19H18N4O2S2/c1-2-3-9-27(24)19-15(20)14-16(12-7-5-4-6-8-12)22-17(23-18(14)26-19)13-10-25-11-21-13/h4-8,10-11H,2-3,9,20H2,1H3
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n/an/a 2.56n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD(+)]


(Mus musculus (Mouse))
BDBM347359
PNG
(US9789116, SW033291)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H20N2OS3/c1-2-3-12-27(24)21-19(22)18-15(14-8-5-4-6-9-14)13-16(23-20(18)26-21)17-10-7-11-25-17/h4-11,13H,2-3,12,22H2,1H3
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n/an/a 2.56n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347429
PNG
(US9789116, SW209415)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cnc(C)n3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C19H21N5OS3/c1-4-5-8-28(25)19-16(20)15-12(14-10-22-11(2)24(14)3)9-13(23-18(15)27-19)17-21-6-7-26-17/h6-7,9-10H,4-5,8,20H2,1-3H3
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n/an/a 2.60n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347375
PNG
(US9789116, SW208080)
Show SMILES CCCCCS(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C22H22N2OS3/c1-2-3-7-13-28(25)22-20(23)19-16(15-9-5-4-6-10-15)14-17(24-21(19)27-22)18-11-8-12-26-18/h4-6,8-12,14H,2-3,7,13,23H2,1H3
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n/an/a 2.61n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347399
PNG
(US9789116, SW208777)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cccnc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C19H18N4OS3/c1-2-3-9-27(24)19-16(20)15-13(12-5-4-6-21-11-12)10-14(23-18(15)26-19)17-22-7-8-25-17/h4-8,10-11H,2-3,9,20H2,1H3
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n/an/a 2.65n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347445
PNG
(US9789116, SW212363)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(OCC(O)=O)cc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C22H21N3O4S3/c1-2-3-10-32(28)22-19(23)18-15(13-4-6-14(7-5-13)29-12-17(26)27)11-16(25-21(18)31-22)20-24-8-9-30-20/h4-9,11H,2-3,10,12,23H2,1H3,(H,26,27)
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n/an/a 2.71n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD(+)]


(Rattus norvegicus (Rat))
BDBM347359
PNG
(US9789116, SW033291)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H20N2OS3/c1-2-3-12-27(24)21-19(22)18-15(14-8-5-4-6-9-14)13-16(23-20(18)26-21)17-10-7-11-25-17/h4-11,13H,2-3,12,22H2,1H3
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n/an/a 2.74n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347393
PNG
(US9789116, SW208660)
Show SMILES CC(C)S(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1ncco1
Show InChI InChI=1S/C19H17N3O2S2/c1-11(2)26(23)19-16(20)15-13(12-6-4-3-5-7-12)10-14(22-18(15)25-19)17-21-8-9-24-17/h3-11H,20H2,1-2H3
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n/an/a 2.86n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347373
PNG
(US9789116, SW208199)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(Br)cc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H19BrN2OS3/c1-2-3-11-28(25)21-19(23)18-15(13-6-8-14(22)9-7-13)12-16(24-20(18)27-21)17-5-4-10-26-17/h4-10,12H,2-3,11,23H2,1H3
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n/an/a 2.90n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347444
PNG
(US9789116, SW212345)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cnc(C4CC4)n3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C21H23N5OS3/c1-3-4-9-30(27)21-17(22)16-13(15-11-24-18(26(15)2)12-5-6-12)10-14(25-20(16)29-21)19-23-7-8-28-19/h7-8,10-12H,3-6,9,22H2,1-2H3
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n/an/a 2.99n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347387
PNG
(US9789116, SW208438)
Show SMILES CC(C)S(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C20H18N2OS3/c1-12(2)26(23)20-18(21)17-14(13-7-4-3-5-8-13)11-15(22-19(17)25-20)16-9-6-10-24-16/h3-12H,21H2,1-2H3
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n/an/a 3.16n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347449
PNG
(US9789116, SW211688)
Show SMILES COCCCS(=O)c1sc2nc(cc(-c3cnc(C)n3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C19H21N5O2S3/c1-11-22-10-14(24(11)2)12-9-13(17-21-5-7-27-17)23-18-15(12)16(20)19(28-18)29(25)8-4-6-26-3/h5,7,9-10H,4,6,8,20H2,1-3H3
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n/an/a 3.33n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347421
PNG
(US9789116, SW209281)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(cc3)C(O)=O)c2c1N)-c1nccs1
Show InChI InChI=1S/C21H19N3O3S3/c1-2-3-10-30(27)21-17(22)16-14(12-4-6-13(7-5-12)20(25)26)11-15(24-19(16)29-21)18-23-8-9-28-18/h4-9,11H,2-3,10,22H2,1H3,(H,25,26)
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n/an/a 3.40n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347442
PNG
(US9789116, SW211535)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cccc(c3)C(=O)NCCO)c2c1N)-c1nccs1
Show InChI InChI=1S/C23H24N4O3S3/c1-2-3-11-33(30)23-19(24)18-16(13-17(27-22(18)32-23)21-26-8-10-31-21)14-5-4-6-15(12-14)20(29)25-7-9-28/h4-6,8,10,12-13,28H,2-3,7,9,11,24H2,1H3,(H,25,29)
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n/an/a 3.45n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347448
PNG
(US9789116, SW212366)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(COC(=O)CN(C)C)cc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C25H28N4O3S3/c1-4-5-12-35(31)25-22(26)21-18(13-19(28-24(21)34-25)23-27-10-11-33-23)17-8-6-16(7-9-17)15-32-20(30)14-29(2)3/h6-11,13H,4-5,12,14-15,26H2,1-3H3
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n/an/a 3.48n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347381
PNG
(US9789116, SW208432)
Show SMILES CCCCS(=O)c1cc2ccc(nc2s1)-c1ccccc1
Show InChI InChI=1S/C17H17NOS2/c1-2-3-11-21(19)16-12-14-9-10-15(18-17(14)20-16)13-7-5-4-6-8-13/h4-10,12H,2-3,11H2,1H3
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n/an/a 3.53n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347417
PNG
(US9789116, SW209277)
Show SMILES CCCCS(=O)c1sc2nc(nc(-c3ccccc3)c2c1N)-c1nccn1C
Show InChI InChI=1S/C20H21N5OS2/c1-3-4-12-28(26)20-15(21)14-16(13-8-6-5-7-9-13)23-17(24-19(14)27-20)18-22-10-11-25(18)2/h5-11H,3-4,12,21H2,1-2H3
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n/an/a 3.71n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347420
PNG
(US9789116, SW209280)
Show SMILES CCCS(=O)c1sc2nc(cc(-c3nccn3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C17H17N5OS3/c1-3-8-26(23)17-13(18)12-10(14-19-4-6-22(14)2)9-11(21-16(12)25-17)15-20-5-7-24-15/h4-7,9H,3,8,18H2,1-2H3
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n/an/a 3.73n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347446
PNG
(US9789116, SW212364)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(OCCO)cc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C22H23N3O3S3/c1-2-3-12-31(27)22-19(23)18-16(14-4-6-15(7-5-14)28-10-9-26)13-17(25-21(18)30-22)20-24-8-11-29-20/h4-8,11,13,26H,2-3,9-10,12,23H2,1H3
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n/an/a 3.97n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347400
PNG
(US9789116, SW208778)
Show SMILES CC(C)S(=O)c1sc2nc(cc(-c3cccnc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C18H16N4OS3/c1-10(2)26(23)18-15(19)14-12(11-4-3-5-20-9-11)8-13(22-17(14)25-18)16-21-6-7-24-16/h3-10H,19H2,1-2H3
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n/an/a 3.99n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347425
PNG
(US9789116, SW209330)
Show SMILES Nc1c(sc2nc(cc(-c3ccccc3)c12)-c1cccs1)[S+]([O-])CCCCl
Show InChI InChI=1S/C20H17ClN2OS3/c21-9-5-11-27(24)20-18(22)17-14(13-6-2-1-3-7-13)12-15(23-19(17)26-20)16-8-4-10-25-16/h1-4,6-8,10,12H,5,9,11,22H2
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n/an/a 4.01n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347450
PNG
(US9789116, SW211689)
Show SMILES COCCS(=O)c1sc2nc(cc(-c3cnc(C)n3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C18H19N5O2S3/c1-10-21-9-13(23(10)2)11-8-12(16-20-4-6-26-16)22-17-14(11)15(19)18(27-17)28(24)7-5-25-3/h4,6,8-9H,5,7,19H2,1-3H3
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n/an/a 4.06n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347419
PNG
(US9789116, SW209279)
Show SMILES CC(C)S(=O)c1sc2nc(cc(-c3nccn3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C17H17N5OS3/c1-9(2)26(23)17-13(18)12-10(14-19-4-6-22(14)3)8-11(21-16(12)25-17)15-20-5-7-24-15/h4-9H,18H2,1-3H3
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n/an/a 4.18n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347432
PNG
(US9789116, SW209418)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cccc(CO)c3)c2c1N)-c1nccs1
Show InChI InChI=1S/C21H21N3O2S3/c1-2-3-9-29(26)21-18(22)17-15(14-6-4-5-13(10-14)12-25)11-16(24-20(17)28-21)19-23-7-8-27-19/h4-8,10-11,25H,2-3,9,12,22H2,1H3
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n/an/a 4.29n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347424
PNG
(US9789116, SW209329)
Show SMILES Nc1c(sc2nc(cc(-c3ccccc3)c12)-c1cccs1)[S+]([O-])CCCCCl
Show InChI InChI=1S/C21H19ClN2OS3/c22-10-4-5-12-28(25)21-19(23)18-15(14-7-2-1-3-8-14)13-16(24-20(18)27-21)17-9-6-11-26-17/h1-3,6-9,11,13H,4-5,10,12,23H2
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n/an/a 4.36n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347367
PNG
(US9789116, SW208065)
Show SMILES CCCCS(=O)c1sc2nc(nc(-c3ccccc3)c2c1N)-c1ccccc1
Show InChI InChI=1S/C22H21N3OS2/c1-2-3-14-28(26)22-18(23)17-19(15-10-6-4-7-11-15)24-20(25-21(17)27-22)16-12-8-5-9-13-16/h4-13H,2-3,14,23H2,1H3
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n/an/a 4.87n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347394
PNG
(US9789116, SW208661 | US9789116, SW208663)
Show SMILES CCCS(=O)c1sc2nc(cc(C)c2c1N)N1CCOCC1
Show InChI InChI=1S/C15H21N3O2S2/c1-3-8-22(19)15-13(16)12-10(2)9-11(17-14(12)21-15)18-4-6-20-7-5-18/h9H,3-8,16H2,1-2H3
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n/an/a 5.27n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347401
PNG
(US9789116, SW208780)
Show SMILES CC(C)S(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C19H17N3OS3/c1-11(2)26(23)19-16(20)15-13(12-6-4-3-5-7-12)10-14(22-18(15)25-19)17-21-8-9-24-17/h3-11H,20H2,1-2H3
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n/an/a 5.55n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347441
PNG
(US9789116, SW209513)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(CN(C)C)cc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C23H26N4OS3/c1-4-5-12-31(28)23-20(24)19-17(16-8-6-15(7-9-16)14-27(2)3)13-18(26-22(19)30-23)21-25-10-11-29-21/h6-11,13H,4-5,12,14,24H2,1-3H3
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n/an/a 5.70n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347422
PNG
(US9789116, SW209282)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(cc3)C(=O)N(C)C)c2c1N)-c1nccs1
Show InChI InChI=1S/C23H24N4O2S3/c1-4-5-12-32(29)23-19(24)18-16(14-6-8-15(9-7-14)22(28)27(2)3)13-17(26-21(18)31-23)20-25-10-11-30-20/h6-11,13H,4-5,12,24H2,1-3H3
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n/an/a 5.87n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347426
PNG
(US9789116, SW209331)
Show SMILES Nc1c(sc2nc(cc(-c3ccccc3)c12)-c1cccs1)[S+]([O-])CCCF
Show InChI InChI=1S/C20H17FN2OS3/c21-9-5-11-27(24)20-18(22)17-14(13-6-2-1-3-7-13)12-15(23-19(17)26-20)16-8-4-10-25-16/h1-4,6-8,10,12H,5,9,11,22H2
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n/an/a 6.14n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347407
PNG
(US9789116, SW209126)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1nccn1C
Show InChI InChI=1S/C21H22N4OS2/c1-3-4-12-28(26)21-18(22)17-15(14-8-6-5-7-9-14)13-16(24-20(17)27-21)19-23-10-11-25(19)2/h5-11,13H,3-4,12,22H2,1-2H3
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n/an/a 6.67n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347397
PNG
(US9789116, SW208664)
Show SMILES CC(C)S(=O)c1sc2nc(cc(C)c2c1N)-c1nccs1
Show InChI InChI=1S/C14H15N3OS3/c1-7(2)21(18)14-11(15)10-8(3)6-9(17-13(10)20-14)12-16-4-5-19-12/h4-7H,15H2,1-3H3
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n/an/a 7.62n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347447
PNG
(US9789116, SW212365)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(OCC(=O)OC)cc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C23H23N3O4S3/c1-3-4-11-33(28)23-20(24)19-16(12-17(26-22(19)32-23)21-25-9-10-31-21)14-5-7-15(8-6-14)30-13-18(27)29-2/h5-10,12H,3-4,11,13,24H2,1-2H3
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n/an/a 8.53n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347427
PNG
(US9789116, SW209332)
Show SMILES Nc1c(sc2nc(cc(-c3ccccc3)c12)-c1cccs1)[S+]([O-])CCCC#N
Show InChI InChI=1S/C21H17N3OS3/c22-10-4-5-12-28(25)21-19(23)18-15(14-7-2-1-3-8-14)13-16(24-20(18)27-21)17-9-6-11-26-17/h1-3,6-9,11,13H,4-5,12,23H2
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n/an/a 8.72n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347430
PNG
(US9789116, SW209416)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cccc(c3)C(=O)OC)c2c1N)-c1nccs1
Show InChI InChI=1S/C22H21N3O3S3/c1-3-4-10-31(27)22-18(23)17-15(13-6-5-7-14(11-13)21(26)28-2)12-16(25-20(17)30-22)19-24-8-9-29-19/h5-9,11-12H,3-4,10,23H2,1-2H3
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n/an/a 8.98n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347423
PNG
(US9789116, SW209283)
Show SMILES CCCCS(=O)c1sc2nc(cc(C(=O)N(C)C)c2c1N)-c1cccs1
Show InChI InChI=1S/C18H21N3O2S3/c1-4-5-9-26(23)18-15(19)14-11(17(22)21(2)3)10-12(20-16(14)25-18)13-7-6-8-24-13/h6-8,10H,4-5,9,19H2,1-3H3
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n/an/a 14.7n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347408
PNG
(US9789116, SW209127)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3ccc(cc3)C(=O)OC)c2c1N)-c1nccs1
Show InChI InChI=1S/C22H21N3O3S3/c1-3-4-11-31(27)22-18(23)17-15(13-5-7-14(8-6-13)21(26)28-2)12-16(25-20(17)30-22)19-24-9-10-29-19/h5-10,12H,3-4,11,23H2,1-2H3
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n/an/a 15.1n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347376
PNG
(US9789116, SW208081)
Show SMILES CCCCCCS(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C23H24N2OS3/c1-2-3-4-8-14-29(26)23-21(24)20-17(16-10-6-5-7-11-16)15-18(25-22(20)28-23)19-12-9-13-27-19/h5-7,9-13,15H,2-4,8,14,24H2,1H3
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n/an/a 17.9n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347431
PNG
(US9789116, SW209417)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cccc(c3)C(=O)N(C)C)c2c1N)-c1nccs1
Show InChI InChI=1S/C23H24N4O2S3/c1-4-5-11-32(29)23-19(24)18-16(14-7-6-8-15(12-14)22(28)27(2)3)13-17(26-21(18)31-23)20-25-9-10-30-20/h6-10,12-13H,4-5,11,24H2,1-3H3
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n/an/a 18.5n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347438
PNG
(US9789116, SW209509)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cccc(c3)C(=O)NCCN(C)C)c2c1N)-c1nccs1
Show InChI InChI=1S/C25H29N5O2S3/c1-4-5-13-35(32)25-21(26)20-18(15-19(29-24(20)34-25)23-28-10-12-33-23)16-7-6-8-17(14-16)22(31)27-9-11-30(2)3/h6-8,10,12,14-15H,4-5,9,11,13,26H2,1-3H3,(H,27,31)
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n/an/a 19.3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347433
PNG
(US9789116, SW209419)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cccc(c3)C(O)=O)c2c1N)-c1nccs1
Show InChI InChI=1S/C21H19N3O3S3/c1-2-3-9-30(27)21-17(22)16-14(12-5-4-6-13(10-12)20(25)26)11-15(24-19(16)29-21)18-23-7-8-28-18/h4-8,10-11H,2-3,9,22H2,1H3,(H,25,26)
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n/an/a 20.2n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347443
PNG
(US9789116, SW212344)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cnc(C(C)C)n3C)c2c1N)-c1nccs1
Show InChI InChI=1S/C21H25N5OS3/c1-5-6-9-30(27)21-17(22)16-13(15-11-24-18(12(2)3)26(15)4)10-14(25-20(16)29-21)19-23-7-8-28-19/h7-8,10-12H,5-6,9,22H2,1-4H3
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n/an/a 20.5n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347413
PNG
(US9789116, SW209273)
Show SMILES CC(=O)OCCC[S+]([O-])c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C22H20N2O3S3/c1-14(25)27-10-6-12-30(26)22-20(23)19-16(15-7-3-2-4-8-15)13-17(24-21(19)29-22)18-9-5-11-28-18/h2-5,7-9,11,13H,6,10,12,23H2,1H3
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n/an/a 21.6n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347374
PNG
(US9789116, SW208078)
Show SMILES CCCCS(=O)(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H20N2O2S3/c1-2-3-12-28(24,25)21-19(22)18-15(14-8-5-4-6-9-14)13-16(23-20(18)27-21)17-10-7-11-26-17/h4-11,13H,2-3,12,22H2,1H3
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n/an/a 25.4n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347411
PNG
(US9789116, SW209271)
Show SMILES Nc1c(sc2nc(cc(-c3ccccc3)c12)-c1cccs1)[S+]([O-])CCCCO
Show InChI InChI=1S/C21H20N2O2S3/c22-19-18-15(14-7-2-1-3-8-14)13-16(17-9-6-11-26-17)23-20(18)27-21(19)28(25)12-5-4-10-24/h1-3,6-9,11,13,24H,4-5,10,12,22H2
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n/an/a 34.2n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347434
PNG
(US9789116, SW209420)
Show SMILES CCCCS(=O)c1sc2nc(cc(-c3cccc(c3)C(=O)N3CCN(C)CC3)c2c1N)-c1nccs1
Show InChI InChI=1S/C26H29N5O2S3/c1-3-4-14-36(33)26-22(27)21-19(16-20(29-24(21)35-26)23-28-8-13-34-23)17-6-5-7-18(15-17)25(32)31-11-9-30(2)10-12-31/h5-8,13,15-16H,3-4,9-12,14,27H2,1-2H3
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n/an/a 36.4n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347414
PNG
(US9789116, SW209274)
Show SMILES Nc1c(sc2nc(cc(-c3ccccc3)c12)-c1cccs1)[S+]([O-])CCCO
Show InChI InChI=1S/C20H18N2O2S3/c21-18-17-14(13-6-2-1-3-7-13)12-15(16-8-4-10-25-16)22-19(17)26-20(18)27(24)11-5-9-23/h1-4,6-8,10,12,23H,5,9,11,21H2
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n/an/a 36.6n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347404
PNG
(US9789116, SW209123)
Show SMILES CCCCS(=O)c1sc2nc(-c3nccs3)c(C(=O)OCC)c(-c3ccc(Br)cc3)c2c1N
Show InChI InChI=1S/C23H22BrN3O3S3/c1-3-5-12-33(29)23-18(25)16-15(13-6-8-14(24)9-7-13)17(22(28)30-4-2)19(27-20(16)32-23)21-26-10-11-31-21/h6-11H,3-5,12,25H2,1-2H3
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n/an/a 40.8n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347410
PNG
(US9789116, SW209129)
Show SMILES CC(=O)OCCCC[S+]([O-])c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C23H22N2O3S3/c1-15(26)28-11-5-6-13-31(27)23-21(24)20-17(16-8-3-2-4-9-16)14-18(25-22(20)30-23)19-10-7-12-29-19/h2-4,7-10,12,14H,5-6,11,13,24H2,1H3
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n/an/a 41.5n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347403
PNG
(US9789116, SW208782)
Show SMILES CCCS(=O)c1sc2nc(cc(C(O)=O)c2c1N)-c1cccs1
Show InChI InChI=1S/C15H14N2O3S3/c1-2-6-23(20)15-12(16)11-8(14(18)19)7-9(17-13(11)22-15)10-4-3-5-21-10/h3-5,7H,2,6,16H2,1H3,(H,18,19)
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n/an/a 70.9n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347415
PNG
(US9789116, SW209275)
Show SMILES CCCCSc1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H20N2S3/c1-2-3-11-25-21-19(22)18-15(14-8-5-4-6-9-14)13-16(23-20(18)26-21)17-10-7-12-24-17/h4-10,12-13H,2-3,11,22H2,1H3
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n/an/a 80n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347398
PNG
(US9789116, SW208776)
Show SMILES CCCCS(=O)c1cc2c(nc(nc2s1)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C22H20N2OS2/c1-2-3-14-27(25)19-15-18-20(16-10-6-4-7-11-16)23-21(24-22(18)26-19)17-12-8-5-9-13-17/h4-13,15H,2-3,14H2,1H3
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n/an/a 93.3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347377
PNG
(US9789116, SW208079)
Show SMILES C[S+]([O-])c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C18H14N2OS3/c1-24(21)18-16(19)15-12(11-6-3-2-4-7-11)10-13(20-17(15)23-18)14-8-5-9-22-14/h2-10H,19H2,1H3
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n/an/a 125n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347394
PNG
(US9789116, SW208661 | US9789116, SW208663)
Show SMILES CCCS(=O)c1sc2nc(cc(C)c2c1N)N1CCOCC1
Show InChI InChI=1S/C15H21N3O2S2/c1-3-8-22(19)15-13(16)12-10(2)9-11(17-14(12)21-15)18-4-6-20-7-5-18/h9H,3-8,16H2,1-2H3
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n/an/a 136n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347366
PNG
(US9789116, SW208064)
Show SMILES CCCCS(=O)c1sc2ncccc2c1N
Show InChI InChI=1S/C11H14N2OS2/c1-2-3-7-16(14)11-9(12)8-5-4-6-13-10(8)15-11/h4-6H,2-3,7,12H2,1H3
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n/an/a 151n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347378
PNG
(US9789116, SW211667)
Show SMILES CCCC[S@+]([O-])c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H20N2OS3/c1-2-3-12-27(24)21-19(22)18-15(14-8-5-4-6-9-14)13-16(23-20(18)26-21)17-10-7-11-25-17/h4-11,13H,2-3,12,22H2,1H3/t27-/m0/s1
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n/an/a 195n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM53662
PNG
(2-Methanesulfonyl-4-phenyl-6-thiophen-2-yl-thieno[...)
Show SMILES CS(=O)(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C18H14N2O2S3/c1-25(21,22)18-16(19)15-12(11-6-3-2-4-7-11)10-13(20-17(15)24-18)14-8-5-9-23-14/h2-10H,19H2,1H3
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US Patent
n/an/a 525n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347412
PNG
(US9789116, SW209272)
Show SMILES CC(=O)OCCCS(=O)(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C22H20N2O4S3/c1-14(25)28-10-6-12-31(26,27)22-20(23)19-16(15-7-3-2-4-8-15)13-17(24-21(19)30-22)18-9-5-11-29-18/h2-5,7-9,11,13H,6,10,12,23H2,1H3
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n/an/a 530n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347392
PNG
(US9789116, SW208599)
Show SMILES CCCCS(=O)c1nc2ccc(nc2s1)-c1cccs1
Show InChI InChI=1S/C14H14N2OS3/c1-2-3-9-20(17)14-16-11-7-6-10(15-13(11)19-14)12-5-4-8-18-12/h4-8H,2-3,9H2,1H3
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n/an/a 1.23E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347395
PNG
(US9789116, SW208662)
Show SMILES CCCCS(=O)c1cc2c(nc(nc2s1)-c1ccccc1)N1CCCCC1
Show InChI InChI=1S/C21H25N3OS2/c1-2-3-14-27(25)18-15-17-20(24-12-8-5-9-13-24)22-19(23-21(17)26-18)16-10-6-4-7-11-16/h4,6-7,10-11,15H,2-3,5,8-9,12-14H2,1H3
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n/an/a 1.32E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347435
PNG
(US9789116, SW209427)
Show SMILES CCCCS(=O)CSc1nc(cc(-c2nccn2C)c1C#N)-c1nccs1
Show InChI InChI=1S/C18H19N5OS3/c1-3-4-9-27(24)12-26-17-14(11-19)13(16-20-5-7-23(16)2)10-15(22-17)18-21-6-8-25-18/h5-8,10H,3-4,9,12H2,1-2H3
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n/an/a 1.49E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347428
PNG
(US9789116, SW209333)
Show SMILES CCCCS(=O)(=O)c1sc2nc(cc(-c3ccc(CO)cc3)c2c1N)-c1nccs1
Show InChI InChI=1S/C21H21N3O3S3/c1-2-3-10-30(26,27)21-18(22)17-15(14-6-4-13(12-25)5-7-14)11-16(24-20(17)29-21)19-23-8-9-28-19/h4-9,11,25H,2-3,10,12,22H2,1H3
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n/an/a>2.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347380
PNG
(US9789116, SW208430)
Show SMILES CCCCSc1cc2ccc(nc2s1)-c1ccccc1
Show InChI InChI=1S/C17H17NS2/c1-2-3-11-19-16-12-14-9-10-15(18-17(14)20-16)13-7-5-4-6-8-13/h4-10,12H,2-3,11H2,1H3
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n/an/a>2.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347382
PNG
(US9789116, SW208434)
Show SMILES CCCCS(=O)(=O)c1cc2ccc(nc2s1)-c1ccccc1
Show InChI InChI=1S/C17H17NO2S2/c1-2-3-11-22(19,20)16-12-14-9-10-15(18-17(14)21-16)13-7-5-4-6-8-13/h4-10,12H,2-3,11H2,1H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347383
PNG
(US9789116, SW208435)
Show SMILES CCCCSc1sc2nc(ccc2c1N)-c1ccccc1
Show InChI InChI=1S/C17H18N2S2/c1-2-3-11-20-17-15(18)13-9-10-14(19-16(13)21-17)12-7-5-4-6-8-12/h4-10H,2-3,11,18H2,1H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347409
PNG
(US9789116, SW209128)
Show SMILES CC(=O)OCCCCS(=O)(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C23H22N2O4S3/c1-15(26)29-11-5-6-13-32(27,28)23-21(24)20-17(16-8-3-2-4-9-16)14-18(25-22(20)31-23)19-10-7-12-30-19/h2-4,7-10,12,14H,5-6,11,13,24H2,1H3
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n/an/a 4.91E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347370
PNG
(US9789116, SW208068)
Show SMILES CCCCSc1ncccc1N
Show InChI InChI=1S/C9H14N2S/c1-2-3-7-12-9-8(10)5-4-6-11-9/h4-6H,2-3,7,10H2,1H3
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n/an/a>7.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347390
PNG
(US9789116, SW208495)
Show SMILES CCCCS(=O)c1nc2nc(ccc2[nH]1)-c1cccs1
Show InChI InChI=1S/C14H15N3OS2/c1-2-3-9-20(18)14-16-11-7-6-10(15-13(11)17-14)12-5-4-8-19-12/h4-8H,2-3,9H2,1H3,(H,15,16,17)
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n/an/a>7.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347362
PNG
(US9789116, SW206978)
Show SMILES CCOC(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C20H16N2O2S2/c1-2-24-20(23)18-17(21)16-13(12-7-4-3-5-8-12)11-14(22-19(16)26-18)15-9-6-10-25-15/h3-11H,2,21H2,1H3
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Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347360
PNG
(US9789116, SW206976)
Show SMILES CCCCC(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C22H20N2OS2/c1-2-3-10-17(25)21-20(23)19-15(14-8-5-4-6-9-14)13-16(24-22(19)27-21)18-11-7-12-26-18/h4-9,11-13H,2-3,10,23H2,1H3
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n/an/a>7.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347372
PNG
(US9789116, SW208070)
Show SMILES CCCCS(=O)c1ncccc1N
Show InChI InChI=1S/C9H14N2OS/c1-2-3-7-13(12)9-8(10)5-4-6-11-9/h4-6H,2-3,7,10H2,1H3
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n/an/a>7.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347371
PNG
(US9789116, SW208069)
Show SMILES CCCCS(=O)c1ncccc1[N+]([O-])=O
Show InChI InChI=1S/C9H12N2O3S/c1-2-3-7-15(14)9-8(11(12)13)5-4-6-10-9/h4-6H,2-3,7H2,1H3
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n/an/a>7.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347389
PNG
(US9789116, SW208494)
Show SMILES CCCCSc1nc2nc(ccc2[nH]1)-c1cccs1
Show InChI InChI=1S/C14H15N3S2/c1-2-3-8-19-14-16-11-7-6-10(15-13(11)17-14)12-5-4-9-18-12/h4-7,9H,2-3,8H2,1H3,(H,15,16,17)
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n/an/a>7.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347363
PNG
(US9789116, SW206979)
Show SMILES Nc1c(sc2nc(cc(-c3ccccc3)c12)-c1cccs1)C(O)=O
Show InChI InChI=1S/C18H12N2O2S2/c19-15-14-11(10-5-2-1-3-6-10)9-12(13-7-4-8-23-13)20-17(14)24-16(15)18(21)22/h1-9H,19H2,(H,21,22)
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n/an/a>7.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

More data for this
Ligand-Target Pair
15-hydroxyprostaglandin dehydrogenase [NAD+]


(Homo sapiens (Human))
BDBM347361
PNG
(US9789116, SW206977)
Show SMILES CCCNC(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1cccs1
Show InChI InChI=1S/C21H19N3OS2/c1-2-10-23-20(25)19-18(22)17-14(13-7-4-3-5-8-13)12-15(24-21(17)27-19)16-9-6-11-26-16/h3-9,11-12H,2,10,22H2,1H3,(H,23,25)
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n/an/a>7.50E+3n/an/an/an/an/an/a



Case Western Reserve University; Board of Regents of the University of Texas System

US Patent


Assay Description
Each compound for inhibiting enzymatic activity of recombinant 15-PGDH in an in vitro assay.


US Patent US9789116 (2017)

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