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Found 32 hits Enz. Inhib. hit(s) with Target = 'Beta-secretase 1 (BACE1)' AND taxid = 10090   
Target
(Institution)
LigandTarget
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
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50393088
PNG
(CHEMBL2152903)
Show SMILES CCn1cc(cc(C)c1=O)[C@@]1(N=C(N)c2c1cccc2F)c1cccc(c1)-c1cncc(c1)C#CC
Show InChI InChI=1S/C30H25FN4O/c1-4-8-20-14-22(17-33-16-20)21-9-6-10-23(15-21)30(24-13-19(3)29(36)35(5-2)18-24)25-11-7-12-26(31)27(25)28(32)34-30/h6-7,9-18H,5H2,1-3H3,(H2,32,34)/t30-/m0/s1
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n/an/a 2.60n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of BACE1-mediated amyloid beta 40 release in C57/BL6 mouse primary cortical neurons after overnight incubation by ELISA


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165909
PNG
(US9067924, 3)
Show SMILES C[C@]1(CCS(=O)(=O)CC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F
Show InChI InChI=1/C18H18ClFN4O3S/c1-18(6-7-28(26,27)10-16(21)24-18)13-8-12(3-4-14(13)20)23-17(25)15-5-2-11(19)9-22-15/h2-5,8-9H,6-7,10H2,1H3,(H2,21,24)(H,23,25)/t18-/s2
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n/an/a 3n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50398267
PNG
(CHEMBL2177304)
Show SMILES CCn1cc(cc(C)c1=O)[C@@]1(N=C(N)c2c1cccc2F)c1cccc(c1)C#CC1CC1
Show InChI InChI=1S/C27H24FN3O/c1-3-31-16-21(14-17(2)26(31)32)27(22-8-5-9-23(28)24(22)25(29)30-27)20-7-4-6-19(15-20)13-12-18-10-11-18/h4-9,14-16,18H,3,10-11H2,1-2H3,(H2,29,30)/t27-/m0/s1
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n/an/a 3.40n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of BACE1-mediated amyloid beta 40 release in C57/BL6 mouse primary cortical neurons after overnight incubation by ELISA


Citation and Details
More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165913
PNG
(US9067924, 7)
Show SMILES CC1C(N)=N[C@@](C)(CCS1(=O)=O)c1cc(NC(=O)c2ccc(F)cn2)ccc1F
Show InChI InChI=1/C19H20F2N4O3S/c1-11-17(22)25-19(2,7-8-29(11,27)28)14-9-13(4-5-15(14)21)24-18(26)16-6-3-12(20)10-23-16/h3-6,9-11H,7-8H2,1-2H3,(H2,22,25)(H,24,26)/t11?,19-/s2
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n/an/a 4n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50131773
PNG
(CHEMBL3634123)
Show SMILES COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)COCC(N)=N1
Show InChI InChI=1/C17H18FN5O3/c1-17(9-26-8-14(19)23-17)11-5-10(3-4-12(11)18)22-16(24)13-6-21-15(25-2)7-20-13/h3-7H,8-9H2,1-2H3,(H2,19,23)(H,22,24)/t17-/s2
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n/an/a 4.30n/an/an/an/an/an/a



Janssen Pharmaceutica NV

Curated by ChEMBL


Assay Description
Inhibition of BACE1 in mouse Neuro-2a cells expressing wild type human APP695 assessed as reduction in amyloid beta-42 production after 18 hrs by san...


J Med Chem 58: 8216-35 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50131774
PNG
(CHEMBL2403769)
Show SMILES C[C@]1(COCC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F
Show InChI InChI=1/C17H16ClFN4O2/c1-17(9-25-8-15(20)23-17)12-6-11(3-4-13(12)19)22-16(24)14-5-2-10(18)7-21-14/h2-7H,8-9H2,1H3,(H2,20,23)(H,22,24)/t17-/s2
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n/an/a 4.5n/an/an/an/an/an/a



Janssen Pharmaceutica NV

Curated by ChEMBL


Assay Description
Inhibition of BACE1 in mouse Neuro-2a cells expressing wild type human APP695 assessed as reduction in amyloid beta-42 production after 18 hrs by san...


J Med Chem 58: 8216-35 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165907
PNG
(US9067924, 1)
Show SMILES C[C@]1(CCSCC(N)=N1)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F
Show InChI InChI=1/C18H18ClFN4OS/c1-18(6-7-26-10-16(21)24-18)13-8-12(3-4-14(13)20)23-17(25)15-5-2-11(19)9-22-15/h2-5,8-9H,6-7,10H2,1H3,(H2,21,24)(H,23,25)/t18-/s2
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n/an/a 6.30n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50131775
PNG
(CHEMBL3634122)
Show SMILES C[C@]1(COCC(N)=N1)c1cccc(NC(=O)c2ccc(Cl)cn2)c1
Show InChI InChI=1/C17H17ClN4O2/c1-17(10-24-9-15(19)22-17)11-3-2-4-13(7-11)21-16(23)14-6-5-12(18)8-20-14/h2-8H,9-10H2,1H3,(H2,19,22)(H,21,23)/t17-/s2
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n/an/a 7.40n/an/an/an/an/an/a



Janssen Pharmaceutica NV

Curated by ChEMBL


Assay Description
Inhibition of BACE1 in mouse Neuro-2a cells expressing wild type human APP695 assessed as reduction in amyloid beta-42 production after 18 hrs by san...


J Med Chem 58: 8216-35 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165908
PNG
(US9067924, 2)
Show SMILES C[C@]1(CCSCC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F
Show InChI InChI=1/C18H18F2N4OS/c1-18(6-7-26-10-16(21)24-18)13-8-12(3-4-14(13)20)23-17(25)15-5-2-11(19)9-22-15/h2-5,8-9H,6-7,10H2,1H3,(H2,21,24)(H,23,25)/t18-/s2
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n/an/a 16n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165910
PNG
(US9067924, 4)
Show SMILES C[C@]1(CCS(=O)(=O)CC(N)=N1)c1cc(NC(=O)c2ccc(F)cn2)ccc1F
Show InChI InChI=1/C18H18F2N4O3S/c1-18(6-7-28(26,27)10-16(21)24-18)13-8-12(3-4-14(13)20)23-17(25)15-5-2-11(19)9-22-15/h2-5,8-9H,6-7,10H2,1H3,(H2,21,24)(H,23,25)/t18-/s2
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n/an/a 20n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165914
PNG
(US9067924, 8)
Show SMILES CC1C(N)=N[C@@](C)(CCS1(=O)=O)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F
Show InChI InChI=1/C19H20ClFN4O3S/c1-11-17(22)25-19(2,7-8-29(11,27)28)14-9-13(4-5-15(14)21)24-18(26)16-6-3-12(20)10-23-16/h3-6,9-11H,7-8H2,1-2H3,(H2,22,25)(H,24,26)/t11?,19-/s2
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n/an/a 30n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50398261
PNG
(CHEMBL2177919)
Show SMILES Cc1cc(cn(C)c1=O)C1(N=C(N)c2c1cccc2F)c1cccc(c1)-c1cncnc1
Show InChI InChI=1S/C25H20FN5O/c1-15-9-19(13-31(2)24(15)32)25(20-7-4-8-21(26)22(20)23(27)30-25)18-6-3-5-16(10-18)17-11-28-14-29-12-17/h3-14H,1-2H3,(H2,27,30)
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n/an/a 30n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of BACE1-mediated amyloid beta 40 release in C57/BL6 mouse primary cortical neurons after overnight incubation by ELISA


Citation and Details
More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50398262
PNG
(CHEMBL2177917)
Show SMILES COc1c(C)cc(nc1C)C1(N=C(N)c2c1cccc2F)c1cccc(c1)-c1cncnc1
Show InChI InChI=1S/C26H22FN5O/c1-15-10-22(31-16(2)24(15)33-3)26(20-8-5-9-21(27)23(20)25(28)32-26)19-7-4-6-17(11-19)18-12-29-14-30-13-18/h4-14H,1-3H3,(H2,28,32)
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n/an/a 40n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of BACE1-mediated amyloid beta 40 release in C57/BL6 mouse primary cortical neurons after overnight incubation by ELISA


Citation and Details
More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50398264
PNG
(CHEMBL2177913)
Show SMILES NC1=N[C@@](c2cccc(F)c12)(c1cccc(c1)-c1cncnc1)c1ccnc(c1)C(F)F
Show InChI InChI=1S/C24H16F3N5/c25-19-6-2-5-18-21(19)23(28)32-24(18,17-7-8-31-20(10-17)22(26)27)16-4-1-3-14(9-16)15-11-29-13-30-12-15/h1-13,22H,(H2,28,32)/t24-/m0/s1
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n/an/a 51n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of BACE1-mediated amyloid beta 40 release in C57/BL6 mouse primary cortical neurons after overnight incubation by ELISA


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165918
PNG
(US9067924, 12)
Show SMILES CC1(C)C(N)=N[C@@](C)(CCS1(=O)=O)c1cc(NC(=O)c2ccc(cn2)[N+]#[C-])ccc1F
Show InChI InChI=1/C21H22FN5O3S/c1-20(2)19(23)27-21(3,9-10-31(20,29)30)15-11-13(5-7-16(15)22)26-18(28)17-8-6-14(24-4)12-25-17/h5-8,11-12H,9-10H2,1-3H3,(H2,23,27)(H,26,28)/t21-/s2
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n/an/a 53n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50398263
PNG
(CHEMBL2177914)
Show SMILES NC1=N[C@@](c2cc(F)cc(F)c12)(c1cccc(c1)-c1cncnc1)c1ccnc(c1)C(F)F
Show InChI InChI=1S/C24H15F4N5/c25-17-8-18-21(19(26)9-17)23(29)33-24(18,16-4-5-32-20(7-16)22(27)28)15-3-1-2-13(6-15)14-10-30-12-31-11-14/h1-12,22H,(H2,29,33)/t24-/m0/s1
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n/an/a 53n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of BACE1-mediated amyloid beta 40 release in C57/BL6 mouse primary cortical neurons after overnight incubation by ELISA


Citation and Details
More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165916
PNG
(US9067924, 10)
Show SMILES CC1(C)C(N)=N[C@@](C)(CCS1(=O)=O)c1cc(NC(=O)c2ccc(F)cn2)ccc1F
Show InChI InChI=1/C20H22F2N4O3S/c1-19(2)18(23)26-20(3,8-9-30(19,28)29)14-10-13(5-6-15(14)22)25-17(27)16-7-4-12(21)11-24-16/h4-7,10-11H,8-9H2,1-3H3,(H2,23,26)(H,25,27)/t20-/s2
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n/an/a 62n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50398265
PNG
(CHEMBL2177904)
Show SMILES NC1=N[C@](c2cccc(F)c12)(c1ccncc1)c1cccc(c1)-c1cncnc1
Show InChI InChI=1S/C23H16FN5/c24-20-6-2-5-19-21(20)22(25)29-23(19,17-7-9-26-10-8-17)18-4-1-3-15(11-18)16-12-27-14-28-13-16/h1-14H,(H2,25,29)/t23-/m1/s1
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n/an/a 68n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of BACE1-mediated amyloid beta 40 release in C57/BL6 mouse primary cortical neurons after overnight incubation by ELISA


Citation and Details
More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165920
PNG
(US9067924, 14)
Show SMILES C[C@@]1(N=C(N)CS(=O)(=O)[C@H]2COC[C@H]12)c1cc(NC(=O)c2ccc(cn2)[N+]#[C-])ccc1F
Show InChI InChI=1/C21H20FN5O4S/c1-21(15-9-31-10-18(15)32(29,30)11-19(23)27-21)14-7-12(3-5-16(14)22)26-20(28)17-6-4-13(24-2)8-25-17/h3-8,15,18H,9-11H2,1H3,(H2,23,27)(H,26,28)/t15-,18-,21+/s2
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n/an/a 78n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165912
PNG
(US9067924, 6)
Show SMILES CC1SCC[C@](C)(N=C1N)c1cc(NC(=O)c2ccc(Cl)cn2)ccc1F
Show InChI InChI=1/C19H20ClFN4OS/c1-11-17(22)25-19(2,7-8-27-11)14-9-13(4-5-15(14)21)24-18(26)16-6-3-12(20)10-23-16/h3-6,9-11H,7-8H2,1-2H3,(H2,22,25)(H,24,26)/t11?,19-/s2
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n/an/a 140n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165911
PNG
(US9067924, 5)
Show SMILES CC1SCC[C@](C)(N=C1N)c1cc(NC(=O)c2ccc(F)cn2)ccc1F
Show InChI InChI=1/C19H20F2N4OS/c1-11-17(22)25-19(2,7-8-27-11)14-9-13(4-5-15(14)21)24-18(26)16-6-3-12(20)10-23-16/h3-6,9-11H,7-8H2,1-2H3,(H2,22,25)(H,24,26)/t11?,19-/s2
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n/an/a 170n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50398277
PNG
(CHEMBL2177909)
Show SMILES NC1=N[C@](c2cccc(F)c12)(c1ccnc(c1)C(F)(F)F)c1ccc(F)c(c1)-c1cncnc1
Show InChI InChI=1S/C24H14F5N5/c25-18-5-4-14(8-16(18)13-10-31-12-32-11-13)23(15-6-7-33-20(9-15)24(27,28)29)17-2-1-3-19(26)21(17)22(30)34-23/h1-12H,(H2,30,34)/t23-/m0/s1
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n/an/a 204n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of BACE1-mediated amyloid beta 40 release in C57/BL6 mouse primary cortical neurons after overnight incubation by ELISA


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165919
PNG
(US9067924, 13)
Show SMILES NC1=NC(CCS(=O)(=O)C1)(C(F)F)c1cc(NC(=O)c2ccc(cn2)[N+]#[C-])ccc1F
Show InChI InChI=1/C19H16F3N5O3S/c1-24-12-3-5-15(25-9-12)17(28)26-11-2-4-14(20)13(8-11)19(18(21)22)6-7-31(29,30)10-16(23)27-19/h2-5,8-9,18H,6-7,10H2,(H2,23,27)(H,26,28)
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US Patent
n/an/a 260n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165915
PNG
(US9067924, 9)
Show SMILES CC1C(N)=N[C@@](C)(CCS1(=O)=O)c1cc(NC(=O)c2[nH]ncc2Cl)ccc1F
Show InChI InChI=1/C17H19ClFN5O3S/c1-9-15(20)23-17(2,5-6-28(9,26)27)11-7-10(3-4-13(11)19)22-16(25)14-12(18)8-21-24-14/h3-4,7-9H,5-6H2,1-2H3,(H2,20,23)(H,21,24)(H,22,25)/t9?,17-/s2
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n/an/a 300n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50398279
PNG
(CHEMBL2177906)
Show SMILES NC1=NC(c2cccc(F)c12)(c1cccc(c1)-c1cncnc1)c1ccnc(c1)C(F)(F)F
Show InChI InChI=1S/C24H15F4N5/c25-19-6-2-5-18-21(19)22(29)33-23(18,17-7-8-32-20(10-17)24(26,27)28)16-4-1-3-14(9-16)15-11-30-13-31-12-15/h1-13H,(H2,29,33)
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n/an/a 436n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of BACE1-mediated amyloid beta 40 release in C57/BL6 mouse primary cortical neurons after overnight incubation by ELISA


Citation and Details
More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50182437
PNG
(CHEMBL3819531)
Show SMILES COc1ccc2C(=O)\C(Cc2c1)=C\C1CCN(Cc2cccc(OC)c2)CC1
Show InChI InChI=1S/C24H27NO3/c1-27-21-5-3-4-18(13-21)16-25-10-8-17(9-11-25)12-20-14-19-15-22(28-2)6-7-23(19)24(20)26/h3-7,12-13,15,17H,8-11,14,16H2,1-2H3/b20-12+
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n/an/a<1.00E+3n/an/an/an/an/an/a



Universit£ degli Studi della Magna Gr£cia Viale Europa

Curated by ChEMBL


Assay Description
Inhibition of mouse BACE-1 preincubated for 10 mins followed by fluorescent peptide substrate addition measured for 30 mins by fluorescence plate rea...


ACS Med Chem Lett 7: 470-5 (2016)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50182442
PNG
(CHEMBL3818616)
Show SMILES Oc1cccc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c12
Show InChI InChI=1S/C22H23NO2/c24-20-8-4-7-18-14-19(22(25)21(18)20)13-16-9-11-23(12-10-16)15-17-5-2-1-3-6-17/h1-8,13,16,24H,9-12,14-15H2/b19-13+
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Universit£ degli Studi della Magna Gr£cia Viale Europa

Curated by ChEMBL


Assay Description
Inhibition of mouse BACE-1 preincubated for 10 mins followed by fluorescent peptide substrate addition measured for 30 mins by fluorescence plate rea...


ACS Med Chem Lett 7: 470-5 (2016)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50182443
PNG
(CHEMBL3819646)
Show SMILES Oc1ccc2C(=O)\C(Cc2c1)=C\C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C22H23NO2/c24-20-6-7-21-18(14-20)13-19(22(21)25)12-16-8-10-23(11-9-16)15-17-4-2-1-3-5-17/h1-7,12,14,16,24H,8-11,13,15H2/b19-12+
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n/an/a<1.00E+3n/an/an/an/an/an/a



Universit£ degli Studi della Magna Gr£cia Viale Europa

Curated by ChEMBL


Assay Description
Inhibition of mouse BACE-1 preincubated for 10 mins followed by fluorescent peptide substrate addition measured for 30 mins by fluorescence plate rea...


ACS Med Chem Lett 7: 470-5 (2016)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50280646
PNG
(2-[1-(1-Benzyl-piperidin-4-yl)-meth-(E)-ylidene]-5...)
Show SMILES COc1cc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H27NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,12,14-15,17H,8-11,13,16H2,1-2H3/b20-12+
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n/an/a<1.00E+3n/an/an/an/an/an/a



Universit£ degli Studi della Magna Gr£cia Viale Europa

Curated by ChEMBL


Assay Description
Inhibition of mouse BACE-1 preincubated for 10 mins followed by fluorescent peptide substrate addition measured for 30 mins by fluorescence plate rea...


ACS Med Chem Lett 7: 470-5 (2016)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50182435
PNG
(CHEMBL3818084)
Show SMILES COc1ccc2C(=O)\C(Cc2c1)=C\C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C23H25NO2/c1-26-21-7-8-22-19(15-21)14-20(23(22)25)13-17-9-11-24(12-10-17)16-18-5-3-2-4-6-18/h2-8,13,15,17H,9-12,14,16H2,1H3/b20-13+
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Universit£ degli Studi della Magna Gr£cia Viale Europa

Curated by ChEMBL


Assay Description
Inhibition of mouse BACE-1 preincubated for 10 mins followed by fluorescent peptide substrate addition measured for 30 mins by fluorescence plate rea...


ACS Med Chem Lett 7: 470-5 (2016)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM50182436
PNG
(CHEMBL3818801)
Show SMILES O=C1\C(Cc2cc3OCOc3cc12)=C\C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C23H23NO3/c25-23-19(11-18-12-21-22(13-20(18)23)27-15-26-21)10-16-6-8-24(9-7-16)14-17-4-2-1-3-5-17/h1-5,10,12-13,16H,6-9,11,14-15H2/b19-10+
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Universit£ degli Studi della Magna Gr£cia Viale Europa

Curated by ChEMBL


Assay Description
Inhibition of mouse BACE-1 preincubated for 10 mins followed by fluorescent peptide substrate addition measured for 30 mins by fluorescence plate rea...


ACS Med Chem Lett 7: 470-5 (2016)

More data for this
Ligand-Target Pair
Beta-secretase 1 (BACE1)


(Mus musculus (Mouse))
BDBM165917
PNG
(US9067924, 11)
Show SMILES C[C@]1(CCS(=O)(=O)C(C)(C)C(N)=N1)c1cc(NC(=O)c2[nH]ncc2Cl)ccc1F
Show InChI InChI=1/C18H21ClFN5O3S/c1-17(2)16(21)24-18(3,6-7-29(17,27)28)11-8-10(4-5-13(11)20)23-15(26)14-12(19)9-22-25-14/h4-5,8-9H,6-7H2,1-3H3,(H2,21,24)(H,22,25)(H,23,26)/t18-/s2
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US Patent
n/an/a 2.29E+3n/an/an/an/an/an/a



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
An ELISA assay (using a pair of mouse anti-human-TMEM27 antibodies, raised against the extracellular domain of TMEM27) is used for detection of TMEM2...


US Patent US9067924 (2015)

More data for this
Ligand-Target Pair