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Patent code US9637499

Compile Data Set for Download or QSAR
Found 10 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
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM47184
PNG
(US8980905, 110 | US9637499, Compound 110)
Show SMILES FC(F)Oc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2OC3(CCSCC3)Oc12
Show InChI InChI=1S/C18H14Cl2F2N2O4S/c19-10-7-23-8-11(20)13(10)24-16(25)9-1-2-12(26-17(21)22)15-14(9)27-18(28-15)3-5-29-6-4-18/h1-2,7-8,17H,3-6H2,(H,23,24,25)
PDB
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US Patent
n/an/a 2n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM150197
PNG
(US8980905, 104 | US9637499, Compound 104)
Show SMILES [O-][n+]1cc(Cl)c(CC(=O)c2ccc(OC(F)F)c3OCC4(CCOCC4)COc23)c(Cl)c1
Show InChI InChI=1S/C21H19Cl2F2NO6/c22-14-8-26(28)9-15(23)13(14)7-16(27)12-1-2-17(32-20(24)25)19-18(12)30-10-21(11-31-19)3-5-29-6-4-21/h1-2,8-9,20H,3-7,10-11H2
PDB
MMDB

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UniProtKB/SwissProt

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US Patent
n/an/a 4n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM150199
PNG
(US8980905, 106 | US9637499, Compound 106)
Show SMILES [O-][n+]1cc(Cl)c(CC(=O)c2ccc(OC(F)F)c3OC4(CCOCC4)Oc23)c(Cl)c1
Show InChI InChI=1S/C19H15Cl2F2NO6/c20-12-8-24(26)9-13(21)11(12)7-14(25)10-1-2-15(28-18(22)23)17-16(10)29-19(30-17)3-5-27-6-4-19/h1-2,8-9,18H,3-7H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

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GoogleScholar
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US Patent
n/an/a 5n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM150194
PNG
(US8980905, 101 | US9637499, Compound 101)
Show SMILES FC(F)Oc1ccc(C(=O)Cc2c(Cl)cncc2Cl)c2OCC3(COC3)COc12
Show InChI InChI=1S/C19H15Cl2F2NO5/c20-12-4-24-5-13(21)11(12)3-14(25)10-1-2-15(29-18(22)23)17-16(10)27-8-19(9-28-17)6-26-7-19/h1-2,4-5,18H,3,6-9H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

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US Patent
n/an/a 6n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM150196
PNG
(US8980905, 103 | US9637499, Compound 103)
Show SMILES FC(F)Oc1ccc(C(=O)Cc2c(Cl)cncc2Cl)c2OCC3(CCOCC3)COc12
Show InChI InChI=1S/C21H19Cl2F2NO5/c22-14-8-26-9-15(23)13(14)7-16(27)12-1-2-17(31-20(24)25)19-18(12)29-10-21(11-30-19)3-5-28-6-4-21/h1-2,8-9,20H,3-7,10-11H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem

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US Patent
n/an/a 6n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM150198
PNG
(US8980905, 105 | US9637499, Compound 105)
Show SMILES FC(F)Oc1ccc(C(=O)Cc2c(Cl)cncc2Cl)c2OC3(CCOCC3)Oc12
Show InChI InChI=1S/C19H15Cl2F2NO5/c20-12-8-24-9-13(21)11(12)7-14(25)10-1-2-15(27-18(22)23)17-16(10)28-19(29-17)3-5-26-6-4-19/h1-2,8-9,18H,3-7H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem

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US Patent
n/an/a 7n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM150201
PNG
(US8980905, 109 | US9637499, Compound 109)
Show SMILES FC(F)Oc1ccc(C(=O)Cc2c(Cl)cncc2Cl)c2OC3(CCS(=O)(=O)CC3)Oc12
Show InChI InChI=1S/C19H15Cl2F2NO6S/c20-12-8-24-9-13(21)11(12)7-14(25)10-1-2-15(28-18(22)23)17-16(10)29-19(30-17)3-5-31(26,27)6-4-19/h1-2,8-9,18H,3-7H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem

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US Patent
n/an/a 13n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM150195
PNG
(US8980905, 102 | US9637499, Compound 102)
Show SMILES [O-][n+]1cc(Cl)c(CC(=O)c2ccc(OC(F)F)c3OCC4(COC4)COc23)c(Cl)c1
Show InChI InChI=1S/C19H15Cl2F2NO6/c20-12-4-24(26)5-13(21)11(12)3-14(25)10-1-2-15(30-18(22)23)17-16(10)28-8-19(9-29-17)6-27-7-19/h1-2,4-5,18H,3,6-9H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC sid
UniChem

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US Patent
n/an/a 13n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM150200
PNG
(US8980905, 108 | US9637499, Compound 108)
Show SMILES [O-][n+]1cc(Cl)c(CC(=O)c2ccc(OC(F)F)c3OC4(CCS(=O)(=O)CC4)Oc23)c(Cl)c1
Show InChI InChI=1S/C19H15Cl2F2NO7S/c20-12-8-24(26)9-13(21)11(12)7-14(25)10-1-2-15(29-18(22)23)17-16(10)30-19(31-17)3-5-32(27,28)6-4-19/h1-2,8-9,18H,3-7H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

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GoogleScholar
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PC cid
PC sid
UniChem

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US Patent
n/an/a 16n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase 4A


(Homo sapiens (human))
BDBM47185
PNG
(US8980905, 111 | US9637499, Compound 111)
Show SMILES [O-][n+]1cc(Cl)c(NC(=O)c2ccc(OC(F)F)c3OC4(CCS(=O)(=O)CC4)Oc23)c(Cl)c1
Show InChI InChI=1S/C18H14Cl2F2N2O7S/c19-10-7-24(26)8-11(20)13(10)23-16(25)9-1-2-12(29-17(21)22)15-14(9)30-18(31-15)3-5-32(27,28)6-4-18/h1-2,7-8,17H,3-6H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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DrugBank
GoogleScholar
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PC cid
PC sid
UniChem

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US Patent
n/an/a 106n/an/an/an/an/an/a



LEO PHARMA A/S

US Patent


Assay Description
Human recombinant PDE4 (Genbank accession no NM_006203) was incubated for 1 hour, with the test compound at concentrations up to 10 μM, with cAM...


US Patent US9637499 (2017)

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