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13 similar compounds to monomer 50003020

Wt: 452.5
BDBM107102
Wt: 470.5
BDBM107103
Wt: 424.4
BDBM107104
Wt: 442.4
BDBM107105
Wt: 424.4
BDBM107106
Wt: 398.4
BDBM107099
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Wt: 416.4
BDBM107100
Wt: 452.5
BDBM107101
Wt: 470.5
BDBM150240
Wt: 412.4
BDBM150233
Wt: 438.4
BDBM150238
Wt: 466.5
BDBM150239
Wt: 452.5
BDBM150245

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 21 hits for monomerid = 107102,107103,107104,107105,107106,107099,107100,107101,150240,150233,150238,150239,150245   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107099
PNG
(US8592371, 1 | US9278976, (3S,5R)-2-(2,5-difluorop...)
Show SMILES CS(=O)(=O)n1cc2CN(Cc2n1)[C@H]1COC([C@@H](N)C1)c1cc(F)ccc1F
Show InChI InChI=1S/C17H20F2N4O3S/c1-27(24,25)23-7-10-6-22(8-16(10)21-23)12-5-15(20)17(26-9-12)13-4-11(18)2-3-14(13)19/h2-4,7,12,15,17H,5-6,8-9,20H2,1H3/t12-,15+,17?/m1/s1
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n/an/a 2.5n/an/an/an/an/an/a



Merck Sharpe & Dohme Corp.

US Patent


Assay Description
Enzyme assay using dipeptidyl peptidase-IV.


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107104
PNG
(US8592371, 6 | US9278976, (3S,5R)-5-[1-(cyclopropa...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)ccc1F)N1Cc2cnn(c2C1)S(=O)(=O)C1CC1
Show InChI InChI=1S/C19H22F2N4O3S/c20-12-1-4-16(21)15(5-12)19-17(22)6-13(10-28-19)24-8-11-7-23-25(18(11)9-24)29(26,27)14-2-3-14/h1,4-5,7,13-14,17,19H,2-3,6,8-10,22H2/t13-,17+,19?/m1/s1
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n/an/a 1.60n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107105
PNG
(US8592371, 8 | US9278976, (3S,5R)-5-[2-(cyclopropa...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)c(F)cc1F)N1Cc2cn(nc2C1)S(=O)(=O)C1CC1
Show InChI InChI=1S/C19H21F3N4O3S/c20-14-5-16(22)15(21)4-13(14)19-17(23)3-11(9-29-19)25-6-10-7-26(24-18(10)8-25)30(27,28)12-1-2-12/h4-5,7,11-12,17,19H,1-3,6,8-9,23H2/t11-,17+,19?/m1/s1
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Merck Sharpe & Dohme Corp.

US Patent


Assay Description
Enzyme assay using dipeptidyl peptidase-IV.


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107102
PNG
(US8592371, 4 | US9278976, (3S,5R)-5-[2-(cyclopenta...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)ccc1F)N1Cc2cn(nc2C1)S(=O)(=O)C1CCCC1
Show InChI InChI=1S/C21H26F2N4O3S/c22-14-5-6-18(23)17(7-14)21-19(24)8-15(12-30-21)26-9-13-10-27(25-20(13)11-26)31(28,29)16-3-1-2-4-16/h5-7,10,15-16,19,21H,1-4,8-9,11-12,24H2/t15-,19+,21?/m1/s1
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n/an/a 1.60n/an/an/an/an/an/a



Merck Sharpe & Dohme Corp.

US Patent


Assay Description
Enzyme assay using dipeptidyl peptidase-IV.


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107106
PNG
(US8592371, 7 | US9278976, (3S,5R)-5-[2-(cyclopropa...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)ccc1F)N1Cc2cn(nc2C1)S(=O)(=O)C1CC1
Show InChI InChI=1S/C19H22F2N4O3S/c20-12-1-4-16(21)15(5-12)19-17(22)6-13(10-28-19)24-7-11-8-25(23-18(11)9-24)29(26,27)14-2-3-14/h1,4-5,8,13-14,17,19H,2-3,6-7,9-10,22H2/t13-,17+,19?/m1/s1
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Merck Sharpe & Dohme Corp.

US Patent


Assay Description
Enzyme assay using dipeptidyl peptidase-IV.


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107103
PNG
(US8592371, 5 | US9278976, (3S,5R)-5-[2-(cyclopenta...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)c(F)cc1F)N1Cc2cn(nc2C1)S(=O)(=O)C1CCCC1
Show InChI InChI=1S/C21H25F3N4O3S/c22-16-7-18(24)17(23)6-15(16)21-19(25)5-13(11-31-21)27-8-12-9-28(26-20(12)10-27)32(29,30)14-3-1-2-4-14/h6-7,9,13-14,19,21H,1-5,8,10-11,25H2/t13-,19+,21?/m1/s1
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n/an/a 1.30n/an/an/an/an/an/a



Merck Sharpe & Dohme Corp.

US Patent


Assay Description
Enzyme assay using dipeptidyl peptidase-IV.


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107104
PNG
(US8592371, 6 | US9278976, (3S,5R)-5-[1-(cyclopropa...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)ccc1F)N1Cc2cnn(c2C1)S(=O)(=O)C1CC1
Show InChI InChI=1S/C19H22F2N4O3S/c20-12-1-4-16(21)15(5-12)19-17(22)6-13(10-28-19)24-8-11-7-23-25(18(11)9-24)29(26,27)14-2-3-14/h1,4-5,7,13-14,17,19H,2-3,6,8-10,22H2/t13-,17+,19?/m1/s1
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Merck Sharpe & Dohme Corp.

US Patent


Assay Description
Enzyme assay using dipeptidyl peptidase-IV.


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107101
PNG
(US8592371, 3)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)c(F)cc1F)N1Cc2cnn(c2C1)S(=O)(=O)C1CCCC1
Show InChI InChI=1S/C21H25F3N4O3S/c22-16-7-18(24)17(23)6-15(16)21-19(25)5-13(11-31-21)27-9-12-8-26-28(20(12)10-27)32(29,30)14-3-1-2-4-14/h6-8,13-14,19,21H,1-5,9-11,25H2/t13-,19+,21?/m1/s1
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Merck Sharpe & Dohme Corp.

US Patent


Assay Description
Enzyme assay using dipeptidyl peptidase-IV.


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM150233
PNG
(US8980929, Example Compound 1)
Show SMILES CS(=O)(=O)n1cc2CN(Cc2n1)[C@H]1CCO[C@@H]([C@@H](N)C1)c1cc(F)ccc1F
Show InChI InChI=1/C18H22F2N4O3S/c1-28(25,26)24-9-11-8-23(10-17(11)22-24)13-4-5-27-18(16(21)7-13)14-6-12(19)2-3-15(14)20/h2-3,6,9,13,16,18H,4-5,7-8,10,21H2,1H3/t13-,16-,18+/s2
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n/an/a 2.30n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM150238
PNG
(US8980929, Example Compound 6)
Show SMILES N[C@H]1C[C@H](CCO[C@@H]1c1cc(F)ccc1F)N1Cc2cn(nc2C1)S(=O)(=O)C1CC1
Show InChI InChI=1/C20H24F2N4O3S/c21-13-1-4-17(22)16(7-13)20-18(23)8-14(5-6-29-20)25-9-12-10-26(24-19(12)11-25)30(27,28)15-2-3-15/h1,4,7,10,14-15,18,20H,2-3,5-6,8-9,11,23H2/t14-,18-,20+/s2
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n/an/a 5.80n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM150239
PNG
(US8980929, Example Compound 7)
Show SMILES Cc1c2CN(Cc2nn1S(=O)(=O)C1(C)CC1)[C@H]1CCO[C@@H]([C@@H](N)C1)c1cc(F)ccc1F
Show InChI InChI=1/C22H28F2N4O3S/c1-13-17-11-27(12-20(17)26-28(13)32(29,30)22(2)6-7-22)15-5-8-31-21(19(25)10-15)16-9-14(23)3-4-18(16)24/h3-4,9,15,19,21H,5-8,10-12,25H2,1-2H3/t15-,19-,21+/s2
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n/an/a 0.5n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM150240
PNG
(US8980929, Example Compound 14 | US8980929, Exampl...)
Show SMILES CC1(CC1)S(=O)(=O)n1cc2CN(Cc2n1)[C@H]1CCO[C@@H]([C@@H](N)C1)c1cc(F)c(F)cc1F
Show InChI InChI=1/C21H25F3N4O3S/c1-21(3-4-21)32(29,30)28-10-12-9-27(11-19(12)26-28)13-2-5-31-20(18(25)6-13)14-7-16(23)17(24)8-15(14)22/h7-8,10,13,18,20H,2-6,9,11,25H2,1H3/t13-,18-,20+/s2
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n/an/a 4n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM150245
PNG
(US8980929, Example Compound 13)
Show SMILES CC1(CC1)S(=O)(=O)n1cc2CN(Cc2n1)[C@H]1CCO[C@@H]([C@@H](N)C1)c1cc(F)ccc1F
Show InChI InChI=1/C21H26F2N4O3S/c1-21(5-6-21)31(28,29)27-11-13-10-26(12-19(13)25-27)15-4-7-30-20(18(24)9-15)16-8-14(22)2-3-17(16)23/h2-3,8,11,15,18,20H,4-7,9-10,12,24H2,1H3/t15-,18-,20+/s2
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n/an/a 8.10n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM150240
PNG
(US8980929, Example Compound 14 | US8980929, Exampl...)
Show SMILES CC1(CC1)S(=O)(=O)n1cc2CN(Cc2n1)[C@H]1CCO[C@@H]([C@@H](N)C1)c1cc(F)c(F)cc1F
Show InChI InChI=1/C21H25F3N4O3S/c1-21(3-4-21)32(29,30)28-10-12-9-27(11-19(12)26-28)13-2-5-31-20(18(25)6-13)14-7-16(23)17(24)8-15(14)22/h7-8,10,13,18,20H,2-6,9,11,25H2,1H3/t13-,18-,20+/s2
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n/an/a 12.6n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107106
PNG
(US8592371, 7 | US9278976, (3S,5R)-5-[2-(cyclopropa...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)ccc1F)N1Cc2cn(nc2C1)S(=O)(=O)C1CC1
Show InChI InChI=1S/C19H22F2N4O3S/c20-12-1-4-16(21)15(5-12)19-17(22)6-13(10-28-19)24-7-11-8-25(23-18(11)9-24)29(26,27)14-2-3-14/h1,4-5,8,13-14,17,19H,2-3,6-7,9-10,22H2/t13-,17+,19?/m1/s1
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n/an/a 1n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107099
PNG
(US8592371, 1 | US9278976, (3S,5R)-2-(2,5-difluorop...)
Show SMILES CS(=O)(=O)n1cc2CN(Cc2n1)[C@H]1COC([C@@H](N)C1)c1cc(F)ccc1F
Show InChI InChI=1S/C17H20F2N4O3S/c1-27(24,25)23-7-10-6-22(8-16(10)21-23)12-5-15(20)17(26-9-12)13-4-11(18)2-3-14(13)19/h2-4,7,12,15,17H,5-6,8-9,20H2,1H3/t12-,15+,17?/m1/s1
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n/an/a 2.5n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107100
PNG
(US8592371, 2 | US9278976, (3S,5R)-5-{2-methanesulf...)
Show SMILES CS(=O)(=O)n1cc2CN(Cc2n1)[C@H]1COC([C@@H](N)C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C17H19F3N4O3S/c1-28(25,26)24-6-9-5-23(7-16(9)22-24)10-2-15(21)17(27-8-10)11-3-13(19)14(20)4-12(11)18/h3-4,6,10,15,17H,2,5,7-8,21H2,1H3/t10-,15+,17?/m1/s1
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n/an/a 2.20n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107105
PNG
(US8592371, 8 | US9278976, (3S,5R)-5-[2-(cyclopropa...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)c(F)cc1F)N1Cc2cn(nc2C1)S(=O)(=O)C1CC1
Show InChI InChI=1S/C19H21F3N4O3S/c20-14-5-16(22)15(21)4-13(14)19-17(23)3-11(9-29-19)25-6-10-7-26(24-18(10)8-25)30(27,28)12-1-2-12/h4-5,7,11-12,17,19H,1-3,6,8-9,23H2/t11-,17+,19?/m1/s1
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n/an/a 1.90n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107102
PNG
(US8592371, 4 | US9278976, (3S,5R)-5-[2-(cyclopenta...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)ccc1F)N1Cc2cn(nc2C1)S(=O)(=O)C1CCCC1
Show InChI InChI=1S/C21H26F2N4O3S/c22-14-5-6-18(23)17(7-14)21-19(24)8-15(12-30-21)26-9-13-10-27(25-20(13)11-26)31(28,29)16-3-1-2-4-16/h5-7,10,15-16,19,21H,1-4,8-9,11-12,24H2/t15-,19+,21?/m1/s1
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n/an/a 1.60n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


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Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107103
PNG
(US8592371, 5 | US9278976, (3S,5R)-5-[2-(cyclopenta...)
Show SMILES N[C@H]1C[C@H](COC1c1cc(F)c(F)cc1F)N1Cc2cn(nc2C1)S(=O)(=O)C1CCCC1
Show InChI InChI=1S/C21H25F3N4O3S/c22-16-7-18(24)17(23)6-15(16)21-19(25)5-13(11-31-21)27-8-12-9-28(26-20(12)10-27)32(29,30)14-3-1-2-4-14/h6-7,9,13-14,19,21H,1-5,8,10-11,25H2/t13-,19+,21?/m1/s1
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n/an/a 1.30n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...


Citation and Details
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4 (DPP4)


(Homo sapiens (human))
BDBM107100
PNG
(US8592371, 2 | US9278976, (3S,5R)-5-{2-methanesulf...)
Show SMILES CS(=O)(=O)n1cc2CN(Cc2n1)[C@H]1COC([C@@H](N)C1)c1cc(F)c(F)cc1F
Show InChI InChI=1S/C17H19F3N4O3S/c1-28(25,26)24-6-9-5-23(7-16(9)22-24)10-2-15(21)17(27-8-10)11-3-13(19)14(20)4-12(11)18/h3-4,6,10,15,17H,2,5,7-8,21H2,1H3/t10-,15+,17?/m1/s1
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n/an/a 2.20n/an/an/an/an/an/a



Merck Sharpe & Dohme Corp.

US Patent


Assay Description
Enzyme assay using dipeptidyl peptidase-IV.


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More data for this
Ligand-Target Pair