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Patent code US9676728

Compile Data Set for Download or QSAR
Found 19 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
Complement factor B


(Homo sapiens (Human))
BDBM181732
PNG
(US9676728, 5 b ()-2-(2,2,2-Trifluoro-1-(2-methoxy...)
Show SMILES CNC(c1nc2cc(ccc2[nH]1)C#N)(c1c(C)cc(C)cc1OC)C(F)(F)F
Show InChI InChI=1S/C20H19F3N4O/c1-11-7-12(2)17(16(8-11)28-4)19(25-3,20(21,22)23)18-26-14-6-5-13(10-24)9-15(14)27-18/h5-9,25H,1-4H3,(H,26,27)
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US Patent
n/an/a 23n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM182861
PNG
(US9676728, 11-B b ()-2-(2,2,2-Trifluoro-1-methoxy...)
Show SMILES COc1cc(C)cc(C)c1C(OC)(c1nc2cc(ccc2[nH]1)C#N)C(F)(F)F
Show InChI InChI=1S/C20H18F3N3O2/c1-11-7-12(2)17(16(8-11)27-3)19(28-4,20(21,22)23)18-25-14-6-5-13(10-24)9-15(14)26-18/h5-9H,1-4H3,(H,25,26)
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n/an/a 55n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Recombinant human factor B (expressed in drosophila cells and purified using standard methods) labeled with biotin (10 nM), europium-labeled streptav...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181734
PNG
(US9676728, 6-A ()-2-(2,2,2-Trifluoro-1-(2-methoxy...)
Show SMILES CNC(c1nc2cc(ccc2[nH]1)C#N)(c1ccc(C)cc1OC)C(F)(F)F
Show InChI InChI=1S/C19H17F3N4O/c1-11-4-6-13(16(8-11)27-3)18(24-2,19(20,21)22)17-25-14-7-5-12(10-23)9-15(14)26-17/h4-9,24H,1-3H3,(H,25,26)
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n/an/a 380n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181724
PNG
(US9676728, 3-B ()-2-(2,2,2-Trifluoro-1-hydroxy-1-...)
Show SMILES COc1cc(C)cc(C)c1C(O)(c1nc2cc(ccc2[nH]1)C#N)C(F)(F)F
Show InChI InChI=1S/C19H16F3N3O2/c1-10-6-11(2)16(15(7-10)27-3)18(26,19(20,21)22)17-24-13-5-4-12(9-23)8-14(13)25-17/h4-8,26H,1-3H3,(H,24,25)
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n/an/a 390n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM182859
PNG
(US9676728, 10-C ()-2-(1-(5-Cyano-1H-benzo[d]imida...)
Show SMILES COc1cc(C)cc(C)c1C(OCC(N)=O)(c1nc2cc(ccc2[nH]1)C#N)C(F)(F)F
Show InChI InChI=1S/C21H19F3N4O3/c1-11-6-12(2)18(16(7-11)30-3)20(21(22,23)24,31-10-17(26)29)19-27-14-5-4-13(9-25)8-15(14)28-19/h4-8H,10H2,1-3H3,(H2,26,29)(H,27,28)
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n/an/a 470n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Recombinant human factor B (expressed in drosophila cells and purified using standard methods) labeled with biotin (10 nM), europium-labeled streptav...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181709
PNG
(US9676728, 2-C ()-2-(1-Hydroxy-1-(2-methoxy-4,6-d...)
Show SMILES COc1cc(C)cc(C)c1C(C)(O)c1nc2cc(ccc2[nH]1)C#N
Show InChI InChI=1S/C19H19N3O2/c1-11-7-12(2)17(16(8-11)24-4)19(3,23)18-21-14-6-5-13(10-20)9-15(14)22-18/h5-9,23H,1-4H3,(H,21,22)
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n/an/a 1.45E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM182856
PNG
(US9676728, 9-C ()-2-(Amino(cyclopropyl)(2-methoxy...)
Show SMILES COc1cc(C)cc(C)c1C(N)(C1CC1)c1nc2cc(ccc2[nH]1)C#N
Show InChI InChI=1S/C21H22N4O/c1-12-8-13(2)19(18(9-12)26-3)21(23,15-5-6-15)20-24-16-7-4-14(11-22)10-17(16)25-20/h4,7-10,15H,5-6,23H2,1-3H3,(H,24,25)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181740
PNG
(US9676728, 6-D ()-2-(1-Amino-2,2,2-trifluoro-1-(2...)
Show SMILES COc1cc(C)cc(C)c1C(N)(c1nc2cc(ccc2[nH]1)C#N)C(F)(F)F
Show InChI InChI=1S/C19H17F3N4O/c1-10-6-11(2)16(15(7-10)27-3)18(24,19(20,21)22)17-25-13-5-4-12(9-23)8-14(13)26-17/h4-8H,24H2,1-3H3,(H,25,26)
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n/an/a 1.57E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181732
PNG
(US9676728, 5 b ()-2-(2,2,2-Trifluoro-1-(2-methoxy...)
Show SMILES CNC(c1nc2cc(ccc2[nH]1)C#N)(c1c(C)cc(C)cc1OC)C(F)(F)F
Show InChI InChI=1S/C20H19F3N4O/c1-11-7-12(2)17(16(8-11)28-4)19(25-3,20(21,22)23)18-26-14-6-5-13(10-24)9-15(14)27-18/h5-9,25H,1-4H3,(H,26,27)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181736
PNG
(US9676728, 6-B ()-2-(1-(3-Chloro-6-methoxy-2,4-di...)
Show SMILES CNC(c1nc2cc(ccc2[nH]1)C#N)(c1c(C)c(Cl)c(C)cc1OC)C(F)(F)F
Show InChI InChI=1S/C20H18ClF3N4O/c1-10-7-15(29-4)16(11(2)17(10)21)19(26-3,20(22,23)24)18-27-13-6-5-12(9-25)8-14(13)28-18/h5-8,26H,1-4H3,(H,27,28)
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n/an/a 1.98E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181738
PNG
(US9676728, 6-C ()-2-(2,2,2-Trifluoro-1-(2-methoxy...)
Show SMILES CNC(c1nc2cc(ccc2[nH]1)C#N)(c1c(C)cccc1OC)C(F)(F)F
Show InChI InChI=1S/C19H17F3N4O/c1-11-5-4-6-15(27-3)16(11)18(24-2,19(20,21)22)17-25-13-8-7-12(10-23)9-14(13)26-17/h4-9,24H,1-3H3,(H,25,26)
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n/an/a 3.13E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181675
PNG
(US9676728, 1-C ()-2-(Hydroxy(2-methoxy-4,6-dimeth...)
Show SMILES COc1cc(C)cc(C)c1C(O)c1nc2cc(ccc2[nH]1)C#N
Show InChI InChI=1S/C18H17N3O2/c1-10-6-11(2)16(15(7-10)23-3)17(22)18-20-13-5-4-12(9-19)8-14(13)21-18/h4-8,17,22H,1-3H3,(H,20,21)
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n/an/a 5.75E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM182228
PNG
(US9676728, 8-B ()-2-(1-Amino-1-(2-methoxy-4,6-dim...)
Show SMILES COc1cc(C)cc(C)c1C(C)(N)c1nc2cc(ccc2[nH]1)C#N
Show InChI InChI=1S/C19H20N4O/c1-11-7-12(2)17(16(8-11)24-4)19(3,21)18-22-14-6-5-13(10-20)9-15(14)23-18/h5-9H,21H2,1-4H3,(H,22,23)
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n/an/a 6.90E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181742
PNG
(US9676728, 6-E ()-2-(1-(3-Bromo-6-methoxy-2,4-dim...)
Show SMILES CNC(c1nc2cc(ccc2[nH]1)C#N)(c1c(C)c(Br)c(C)cc1OC)C(F)(F)F
Show InChI InChI=1S/C20H18BrF3N4O/c1-10-7-15(29-4)16(11(2)17(10)21)19(26-3,20(22,23)24)18-27-13-6-5-12(9-25)8-14(13)28-18/h5-8,26H,1-4H3,(H,27,28)
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n/an/a 7.00E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Recombinant human factor B (expressed in drosophila cells and purified using standard methods) labeled with biotin (10 nM), europium-labeled streptav...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM182103
PNG
(US9676728, 7-D ()-2-(Amino(2-methoxy-4,6-dimethyl...)
Show SMILES COc1cc(C)cc(C)c1C(N)c1nc2cc(ccc2[nH]1)C#N
Show InChI InChI=1S/C18H18N4O/c1-10-6-11(2)16(15(7-10)23-3)17(20)18-21-13-5-4-12(9-19)8-14(13)22-18/h4-8,17H,20H2,1-3H3,(H,21,22)
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n/an/a 8.70E+3n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM182866
PNG
(US9676728, 12-D (B) ()-2-(1-(2,6-dimethoxy-4-meth...)
Show SMILES CNC(c1nc2cc(ccc2[nH]1)C#N)(c1c(OC)cc(C)cc1OC)C(F)(F)F
Show InChI InChI=1S/C20H19F3N4O2/c1-11-7-15(28-3)17(16(8-11)29-4)19(25-2,20(21,22)23)18-26-13-6-5-12(10-24)9-14(13)27-18/h5-9,25H,1-4H3,(H,26,27)
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n/an/a 1.11E+4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM182865
PNG
(US9676728, 12-D (A) ()-2-((2,6-Dimethoxy-4-methyl...)
Show SMILES CNC(c1nc2cc(ccc2[nH]1)C#N)c1c(OC)cc(C)cc1OC
Show InChI InChI=1S/C19H20N4O2/c1-11-7-15(24-3)17(16(8-11)25-4)18(21-2)19-22-13-6-5-12(10-20)9-14(13)23-19/h5-9,18,21H,1-4H3,(H,22,23)
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n/an/a 1.39E+4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM182861
PNG
(US9676728, 11-B b ()-2-(2,2,2-Trifluoro-1-methoxy...)
Show SMILES COc1cc(C)cc(C)c1C(OC)(c1nc2cc(ccc2[nH]1)C#N)C(F)(F)F
Show InChI InChI=1S/C20H18F3N3O2/c1-11-7-12(2)17(16(8-11)27-3)19(28-4,20(21,22)23)18-25-14-6-5-13(10-24)9-15(14)26-18/h5-9H,1-4H3,(H,25,26)
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n/an/a 4.11E+4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Recombinant human factor B (expressed in drosophila cells and purified using standard methods) labeled with biotin (10 nM), europium-labeled streptav...


US Patent US9676728 (2017)

More data for this
Ligand-Target Pair
Complement factor B


(Homo sapiens (Human))
BDBM181729
PNG
(US9676728, 4 ()-2-(1-(3-bromo-6-methoxy-2,4-dimet...)
Show SMILES COc1cc(C)c(Br)c(C)c1C(O)(c1nc2cc(ccc2[nH]1)C#N)C(F)(F)F
Show InChI InChI=1S/C19H15BrF3N3O2/c1-9-6-14(28-3)15(10(2)16(9)20)18(27,19(21,22)23)17-25-12-5-4-11(8-24)7-13(12)26-17/h4-7,27H,1-3H3,(H,25,26)
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n/an/a 9.89E+4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Recombinant human factor B (expressed in drosophila cells and purified using standard methods) labeled with biotin (10 nM), europium-labeled streptav...


US Patent US9676728 (2017)

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