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Patent code US10035777

Compile Data Set for Download or QSAR
Found 109 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
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279457
PNG
((R)-1-(5-(7H-pyrrolo[2, 3-d]pyrimidin-4-yl)-1H-ben...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C18H18N6/c1-10(2)7-13(19)18-23-14-4-3-11(8-15(14)24-18)16-12-5-6-20-17(12)22-9-21-16/h3-6,8-10,13H,7,19H2,1-2H3/b16-11+/t13-/m1/s1
PDB

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n/an/a 4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279455
PNG
((R)-1-(5-(1H-pyrrolo[2, 3-b]pyridin-4-yl)-1H-benzo...)
Show SMILES CC(C)C[C@@H](NC(=O)OCc1ccccc1)c1nc2ccc(cc2[nH]1)B(O)O
PDB

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n/an/a 5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279509
PNG
((R)-4-(2-(3-methyl-1-(methylamino)butyl)-1H-benzo[...)
Show SMILES CN[C@H](CC(C)C)c1nc2cc(ccc2[nH]1)-c1ccnc(N)c1
PDB

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n/an/a 7n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279510
PNG
((R)-1-Cyclohexyl-N-methyl-1-(5-(pyridin-4-yl)-1H-b...)
Show SMILES CNC(C1CCCCC1)c1nc2cc(ccc2[nH]1)-c1ccncc1
PDB

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n/an/a 8n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279511
PNG
((R)-N-methyl-4-(2-(3-methyl-1-(methylamino) butyl)...)
Show SMILES CN[C@H](CC(C)C)c1nc2cc(ccc2[nH]1)-c1ccnc(NC)c1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279456
PNG
((R)-1-(5-(1H-pyrazolo[3, 4-b]pyridin-4-yl)-1H-benz...)
Show SMILES CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc(Br)ccc1N
Show InChI InChI=1S/C17H26BrN3O3/c1-10(2)8-14(21-16(23)24-17(3,4)5)15(22)20-13-9-11(18)6-7-12(13)19/h6-7,9-10,14H,8,19H2,1-5H3,(H,20,22)(H,21,23)/t14-/m1/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279512
PNG
(N,3-dimethyl-1-(5-(pyridin-4-yl)-1H-benzo[d]imidaz...)
Show SMILES CC(C)C[C@@H](N(C)C(=O)OC(C)(C)C)C(=O)Nc1ccc(Br)cc1N
Show InChI InChI=1S/C18H28BrN3O3/c1-11(2)9-15(22(6)17(24)25-18(3,4)5)16(23)21-14-8-7-12(19)10-13(14)20/h7-8,10-11,15H,9,20H2,1-6H3,(H,21,23)/t15-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279479
PNG
((R)-1-(5-methoxy-6-(oxazol-5-yl)-1H-benzo[d]imidaz...)
Show SMILES COc1cc2nc([nH]c2cc1C=C)[C@@H](CC(C)C)NC(=O)OCc1ccccc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279458
PNG
((R)-3-methyl-1-(5-(quinolin-4-yl)-1H-benzo[d]imida...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1ccnc2ccccc12
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279513
PNG
((R)-N-(4-(2-(3-methyl-1-(methylamino)butyl)-1H-ben...)
Show SMILES CC(C)C[C@@H](N(C)C(=O)OC(C)(C)C)c1nc2cc(ccc2[nH]1)-c1ccnc(NC(C)=O)c1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279557
PNG
(1-(6-methoxy-5-(oxazol-5-yl)-1H-benzo[d]imidazol-2...)
Show SMILES CNC(CC(C)C)c1nc2cc(-c3cnco3)c(OC)cc2[nH]1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279514
PNG
((R)-cyclohexyl(6-methoxy-5-(oxazol-5-yl)-1H-benzo[...)
Show SMILES COc1cc2[nH]c(nc2cc1-c1cnco1)[C@H](N)C1CCCCC1
PDB

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n/an/a 16n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279468
PNG
((R)-4-(2-(1-amino-3-methylbutyl)-1H-benzo[d]imidaz...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1ccnc(N)c1
PDB

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n/an/a 19n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279487
PNG
((R)-3-methyl-1-(6-(pyridin-4-yl)-1-(2,2,2-trifluor...)
Show SMILES CC(C)C[C@H](N)c1nc2ccc(cc2n1CC(F)(F)F)-c1ccncc1
Show InChI InChI=1S/C19H21F3N4/c1-12(2)9-15(23)18-25-16-4-3-14(13-5-7-24-8-6-13)10-17(16)26(18)11-19(20,21)22/h3-8,10,12,15H,9,11,23H2,1-2H3/t15-/m0/s1
PDB

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n/an/a 19n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279485
PNG
((R)-1-(6-(3-methoxypyridin-4-yl)-1-(2,2,2-trifluor...)
Show SMILES COc1cnccc1-c1ccc2nc([C@H](N)CC(C)C)n(CC(F)(F)F)c2c1
Show InChI InChI=1S/C20H23F3N4O/c1-12(2)8-15(24)19-26-16-5-4-13(14-6-7-25-10-18(14)28-3)9-17(16)27(19)11-20(21,22)23/h4-7,9-10,12,15H,8,11,24H2,1-3H3/t15-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279515
PNG
(4-methyl-2-(5-(oxazol-5-yl)-1H-benzo[d]imidazol-2-...)
Show SMILES CC(C)CC(CN)c1nc2cc(ccc2[nH]1)-c1cnco1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279481
PNG
((R)-1-(5-fluoro-6-(oxazol-5-yl)-1H-benzo[d]imidazo...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(F)c(cc2[nH]1)-c1cnco1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279471
PNG
((R)-1-(7-methoxy-5-(oxazol-5-yl)-1H-benzo[d]imidaz...)
Show SMILES COc1cc(cc2nc([nH]c12)[C@H](N)CC(C)C)-c1cnco1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279551
PNG
((R)-N,3-dimethyl-1-(6-(oxazol-5-yl)-1H-benzo[d]imi...)
Show SMILES CN[C@H](CC(C)C)c1nc2ccc(cc2[nH]1)-c1cnco1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279450
PNG
((R)-3-methyl-1-(5-(pyridin-4-yl)-1H-benzo[d]imidaz...)
Show SMILES CC(C)C[C@@H](NC(=O)OCc1ccccc1)c1nc2cc(Br)ccc2[nH]1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279508
PNG
(2-(4-methylpentan-2-yl)-5-(pyridin-4-yl)-1H-benzo[...)
Show SMILES CC(C)CC(C)c1nc2cc(ccc2[nH]1)-c1ccncc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279469
PNG
((R)-1-(5-(3, 5-dimethyl-1H-pyrazol-4-yl)-1H-benzo[...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1c(C)n[nH]c1C
Show InChI InChI=1S/C17H21N5/c1-9(2)7-13(18)17-19-14-6-5-12(8-15(14)20-17)16-10(3)21-22-11(16)4/h5-6,8-9,13H,7,18H2,1-4H3/t13-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279460
PNG
((R)-1-(5-(3-fluoropyridin-4-yl)-1H-benzo[d]imidazo...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1ccncc1F
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279548
PNG
(3-methyl-1-(6-(pyridin-4-yl)benzo[d]thiazol-2-yl)b...)
Show SMILES Nc1ccc(cc1SSc1cc(ccc1N)-c1ccncc1)-c1ccncc1
Show InChI InChI=1S/C22H18N4S2/c23-19-3-1-17(15-5-9-25-10-6-15)13-21(19)27-28-22-14-18(2-4-20(22)24)16-7-11-26-12-8-16/h1-14H,23-24H2
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279516
PNG
(3-methyl-1-(5-(pyridin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES CC(C)C[C@@H](NCC(F)(F)F)c1nc2cc(ccc2[nH]1)-c1ccncc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279517
PNG
(4-methyl-2-(5-(pyridin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES CC(C)CC(CNC(=O)OC(C)(C)C)C(=O)Nc1ccc(Br)cc1N
Show InChI InChI=1S/C18H28BrN3O3/c1-11(2)8-12(10-21-17(24)25-18(3,4)5)16(23)22-15-7-6-13(19)9-14(15)20/h6-7,9,11-12H,8,10,20H2,1-5H3,(H,21,24)(H,22,23)
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279518
PNG
((R)-cyclopentyl (6-methoxy-5-(oxazol-5-yl)-1H-benz...)
Show SMILES COc1cc(NC(=O)[C@H](NC(=O)OC(C)(C)C)C2CCCC2)c(N)cc1Br
Show InChI InChI=1S/C19H28BrN3O4/c1-19(2,3)27-18(25)23-16(11-7-5-6-8-11)17(24)22-14-10-15(26-4)12(20)9-13(14)21/h9-11,16H,5-8,21H2,1-4H3,(H,22,24)(H,23,25)/t16-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279472
PNG
((R)-1-(7-methoxy-5-(pyridin-4-yl)-1H-benzo[d]imida...)
Show SMILES COc1cc(cc2nc([nH]c12)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)-c1ccncc1
PDB

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n/an/a 52n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279453
PNG
((R)-3-methyl-1-(5-(oxazol-5-yl)-1H-benzo[d]imidazo...)
Show SMILES CC(C)C[C@@H](NC(=O)OCc1ccccc1)c1nc2cc(C=C)ccc2[nH]1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279451
PNG
((S)-3-methyl-1-(6-(pyridin-4-yl)-1H-benzo[d]imidaz...)
Show SMILES CC(C)C[C@H](N)c1nc2ccc(cc2[nH]1)-c1ccncc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279452
PNG
((R)-1-(5-(1H-pyrazol-3-yl)-1H-benzo[d]imidazol-2-y...)
Show SMILES CC(C)C[C@@H](NC(=O)OCc1ccccc1)c1nc2cc(ccc2[nH]1)-c1cc[nH]n1
Show InChI InChI=1S/C23H23N5O2/c1-15(2)12-21(27-23(29)30-14-16-6-4-3-5-7-16)22-25-19-9-8-17(13-20(19)26-22)18-10-11-24-28-18/h3-11,13,15,21H,12,14H2,1-2H3,(H,27,29)/b18-17+/t21-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279519
PNG
(5-(2-(cyclopentylmethyl)-6-methoxy-1H-benzo[d]imid...)
Show SMILES COc1cc(NC(=O)CC2CCCC2)c(N)cc1Br
Show InChI InChI=1S/C14H19BrN2O2/c1-19-13-8-12(11(16)7-10(13)15)17-14(18)6-9-4-2-3-5-9/h7-9H,2-6,16H2,1H3,(H,17,18)
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279558
PNG
(2-(6-methoxy-5-(oxazol-5-yl)-1H-benzo[d]imidazol-2...)
Show SMILES COc1cc2[nH]c(nc2cc1-c1cnco1)C(C)(N)CC(C)C
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279520
PNG
((R)-2-cyclopropyl-1-(5-(pyridin-4-yl)-1H-benzo[d]i...)
Show SMILES CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)Nc1ccc(Br)cc1N
Show InChI InChI=1S/C17H24BrN3O3/c1-17(2,3)24-16(23)21-14(8-10-4-5-10)15(22)20-13-7-6-11(18)9-12(13)19/h6-7,9-10,14H,4-5,8,19H2,1-3H3,(H,20,22)(H,21,23)/t14-/m1/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279538
PNG
(2-(4-methylpentan-2-yl)-5-(pyridin-4-yl)benzo[d]ox...)
Show SMILES CC(C)CC(C)c1nc2cc(ccc2o1)-c1ccncc1
Show InChI InChI=1S/C18H20N2O/c1-12(2)10-13(3)18-20-16-11-15(4-5-17(16)21-18)14-6-8-19-9-7-14/h4-9,11-13H,10H2,1-3H3
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279521
PNG
(2-cyclopentyl-1-(6-methoxy-5-(oxazol-5-yl)-1H-benz...)
Show SMILES COc1cc(NC(=O)C(CC2CCCC2)NC(=O)OC(C)(C)C)c(N)cc1Br
Show InChI InChI=1S/C20H30BrN3O4/c1-20(2,3)28-19(26)24-16(9-12-7-5-6-8-12)18(25)23-15-11-17(27-4)13(21)10-14(15)22/h10-12,16H,5-9,22H2,1-4H3,(H,23,25)(H,24,26)
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279533
PNG
(3-methyl-1-(5-(pyridin-4-yl)benzo[d]oxazol-2-yl)bu...)
Show SMILES CC(C)CC(N)c1nc2cc(ccc2o1)-c1ccncc1
Show InChI InChI=1S/C17H19N3O/c1-11(2)9-14(18)17-20-15-10-13(3-4-16(15)21-17)12-5-7-19-8-6-12/h3-8,10-11,14H,9,18H2,1-2H3
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279480
PNG
((R)-1-(6-fluoro-5-(pyridin-4-yl)-1H-benzo[d]imidaz...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(c(F)cc2[nH]1)-c1ccncc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279537
PNG
(2-(4-methylpentan-2-yl)-6-(pyridin-4-yl)benzo[d]ox...)
Show SMILES CC(C)CC(C)c1nc2ccc(cc2o1)-c1ccncc1
Show InChI InChI=1S/C18H20N2O/c1-12(2)10-13(3)18-20-16-5-4-15(11-17(16)21-18)14-6-8-19-9-7-14/h4-9,11-13H,10H2,1-3H3
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279454
PNG
((S)-3-methyl-1-(5-(oxazol-5-yl)-1H-benzo[d]imidazo...)
Show SMILES CC(C)C[C@H](N)c1nc2cc(ccc2[nH]1)-c1cnco1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279461
PNG
((R)-1-(5-(3-methoxypyridin-4-yl)-1H-benzo[d]imidaz...)
Show SMILES COc1cnccc1-c1ccc2[nH]c(nc2c1)[C@H](N)CC(C)C
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279484
PNG
((R)-1-(1-ethyl-6-(1H-pyrazol-4-yl)-1H-benzo[d]imid...)
Show SMILES CCn1c(nc2ccc(cc12)-c1cn[nH]c1)[C@H](N)CC(C)C
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279545
PNG
(3-methyl-1-(5-(pyridin-4-yl)benzo[d]thiazol-2-yl)b...)
Show SMILES CC(C)CC(N)c1nc2cc(ccc2s1)-c1ccncc1
Show InChI InChI=1S/C17H19N3S/c1-11(2)9-14(18)17-20-15-10-13(3-4-16(15)21-17)12-5-7-19-8-6-12/h3-8,10-11,14H,9,18H2,1-2H3
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279493
PNG
((R)-3-methyl-1-(1-propyl-6-(pyridin-4-yl)-1H-benzo...)
Show SMILES CCCn1c(nc2ccc(cc12)-c1ccncc1)[C@H](N)CC(C)C
Show InChI InChI=1S/C20H26N4/c1-4-11-24-19-13-16(15-7-9-22-10-8-15)5-6-18(19)23-20(24)17(21)12-14(2)3/h5-10,13-14,17H,4,11-12,21H2,1-3H3/t17-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279549
PNG
(2-(cyclopentylmethyl)-5-(pyridin-4-yl)-1H-benzo[d]...)
Show SMILES C(C1CCCC1)c1nc2cc(ccc2[nH]1)-c1ccncc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279522
PNG
(2-(cyclohexylmethyl)-5-(pyridin-4-yl)-1H-benzo[d]i...)
Show SMILES Nc1cc(Br)ccc1NC(=O)CC1CCCCC1
Show InChI InChI=1S/C14H19BrN2O/c15-11-6-7-13(12(16)9-11)17-14(18)8-10-4-2-1-3-5-10/h6-7,9-10H,1-5,8,16H2,(H,17,18)
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279483
PNG
((R)-1-(1-ethyl-6-(pyridin-4-yl)-1H-benzo[d]imidazo...)
Show SMILES CCn1c(nc2ccc(cc12)-c1ccncc1)[C@@H](CC(C)C)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C27H30N4O2/c1-4-31-25-17-22(21-12-14-28-15-13-21)10-11-23(25)29-26(31)24(16-19(2)3)30-27(32)33-18-20-8-6-5-7-9-20/h5-15,17,19,24H,4,16,18H2,1-3H3,(H,30,32)/t24-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279556
PNG
(2-isopentyl-6-(pyridin-4-yl)-1H-benzo[d]imidazole ...)
Show SMILES CC(C)CCc1nc2ccc(cc2[nH]1)-c1ccncc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279546
PNG
((R)-3-methyl-1-(5-(pyridin-4-yl)benzo[d]thiazol-2-...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2s1)-c1ccncc1
Show InChI InChI=1S/C17H19N3S/c1-11(2)9-14(18)17-20-15-10-13(3-4-16(15)21-17)12-5-7-19-8-6-12/h3-8,10-11,14H,9,18H2,1-2H3/t14-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279494
PNG
((R)-1-(1-isopropyl-6-(pyridin-4-yl)-1H-benzo[d]imi...)
Show SMILES CC(C)C[C@@H](N)c1nc2ccc(cc2n1C(C)C)-c1ccncc1
Show InChI InChI=1S/C20H26N4/c1-13(2)11-17(21)20-23-18-6-5-16(15-7-9-22-10-8-15)12-19(18)24(20)14(3)4/h5-10,12-14,17H,11,21H2,1-4H3/t17-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279543
PNG
(4,4,4-trifluoro-1-(5-(pyridin-4-yl)benzo[d]oxazol-...)
Show SMILES NC(CCC(F)(F)F)c1nc2cc(ccc2o1)-c1ccncc1
Show InChI InChI=1S/C16H14F3N3O/c17-16(18,19)6-3-12(20)15-22-13-9-11(1-2-14(13)23-15)10-4-7-21-8-5-10/h1-2,4-5,7-9,12H,3,6,20H2
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279462
PNG
((R)-1-(5-(2-fluoropyridin-4-yl)-1H-benzo[d]imidazo...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1ccnc(F)c1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279555
PNG
(4,4,4-trifluoro-1-(6-(oxazol-5-yl)-1H-benzo[d]imid...)
Show SMILES NC(CCC(F)(F)F)c1nc2ccc(cc2[nH]1)-c1cnco1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279553
PNG
(4-methyl-2-(6-(oxazol-5-yl)-1H-benzo[d]imidazol-2-...)
Show SMILES CC(C)CC(C)(N)c1nc2ccc(cc2[nH]1)-c1cnco1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279492
PNG
((R)-3-methyl-1-(1-methyl-6-(pyridin-4-yl)-1H-benzo...)
Show SMILES CC(C)C[C@@H](N)c1nc2ccc(cc2n1C)-c1ccncc1
Show InChI InChI=1S/C18H22N4/c1-12(2)10-15(19)18-21-16-5-4-14(11-17(16)22(18)3)13-6-8-20-9-7-13/h4-9,11-12,15H,10,19H2,1-3H3/t15-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279463
PNG
((R)-1-(5-(2-methoxypyridin-4-yl)-1H-benzo[d]imidaz...)
Show SMILES COc1cc(ccn1)-c1ccc2[nH]c(nc2c1)[C@H](N)CC(C)C
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279486
PNG
((R)-3-methyl-1-(6-(oxazol-5-yl)-1-(2, 2,2-trifluor...)
Show SMILES CC(C)C[C@@H](N)c1nc2ccc(cc2n1CC(F)(F)F)-c1cnco1
Show InChI InChI=1S/C17H19F3N4O/c1-10(2)5-12(21)16-23-13-4-3-11(15-7-22-9-25-15)6-14(13)24(16)8-17(18,19)20/h3-4,6-7,9-10,12H,5,8,21H2,1-2H3/t12-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279523
PNG
(1-(6-methoxy-5-(pyridin-4-yl)-1H-benzo[d]imidazol-...)
Show SMILES COc1cc(NC(=O)C(CC(C)C)N(C)C(=O)OC(C)(C)C)c(N)cc1Br
Show InChI InChI=1S/C19H30BrN3O4/c1-11(2)8-15(23(6)18(25)27-19(3,4)5)17(24)22-14-10-16(26-7)12(20)9-13(14)21/h9-11,15H,8,21H2,1-7H3,(H,22,24)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279464
PNG
((R)-4-(2-(1-amino-3-methylbutyl)-1H-benzo[d]imidaz...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1ccnc(n1)N(C)C
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279466
PNG
((R)-4-(2-(1-amino-3-methylbutyl)-1H-benzo[d]imidaz...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1ccnc(N)n1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279476
PNG
(5-(2-isopentyl-4-methoxy-1H-benzo[d]imidazol-6-yl)...)
Show SMILES COc1cc(cc2[nH]c(CCC(C)C)nc12)-c1cnco1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279524
PNG
((R)-cyclopropyl (5-(pyridin-4-yl)-1H-benzo[d]imida...)
Show SMILES CC(C)(C)OC(=O)N[C@H](C1CC1)C(=O)Nc1ccc(Br)cc1N
Show InChI InChI=1S/C16H22BrN3O3/c1-16(2,3)23-15(22)20-13(9-4-5-9)14(21)19-12-7-6-10(17)8-11(12)18/h6-9,13H,4-5,18H2,1-3H3,(H,19,21)(H,20,22)/t13-/m1/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279502
PNG
(3,3,3-trifluoro-2-methyl-1-(6-(pyridin-4-yl)-1H-be...)
Show SMILES CC(C(NC(=O)OC(C)(C)C)C(=O)Nc1ccc(cc1N)-c1ccncc1)C(F)(F)F
Show InChI InChI=1S/C21H25F3N4O3/c1-12(21(22,23)24)17(28-19(30)31-20(2,3)4)18(29)27-16-6-5-14(11-15(16)25)13-7-9-26-10-8-13/h5-12,17H,25H2,1-4H3,(H,27,29)(H,28,30)
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279525
PNG
((R)-N,N-dimethyl-4-(2-(3-methyl-1-(methylamino) bu...)
Show SMILES CC(C)C[C@@H](N(C)C(=O)OC(C)(C)C)c1nc2cc(ccc2[nH]1)-c1ccnc(c1)N(C)C
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279490
PNG
((R)-2-(2-(1-amino-3-methylbutyl)-6-(pyridin-4-yl)-...)
Show SMILES CC(C)C[C@@H](N)c1nc2ccc(cc2n1CCO)-c1ccncc1
Show InChI InChI=1S/C19H24N4O/c1-13(2)11-16(20)19-22-17-4-3-15(14-5-7-21-8-6-14)12-18(17)23(19)9-10-24/h3-8,12-13,16,24H,9-11,20H2,1-2H3/t16-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279465
PNG
((R)-4-(2-(1-amino-3-methylbutyl)-1H-benzo[d]imidaz...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1ccnc(c1)C#N
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279544
PNG
(1-(5-(3-methoxypyridin-4-yl)benzo[d]oxazol-2-yl)-3...)
Show SMILES COc1cnccc1-c1ccc2oc(nc2c1)C(N)CC(C)C
Show InChI InChI=1S/C18H21N3O2/c1-11(2)8-14(19)18-21-15-9-12(4-5-16(15)23-18)13-6-7-20-10-17(13)22-3/h4-7,9-11,14H,8,19H2,1-3H3
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279539
PNG
(2-isopentyl-5-(pyridin-4-yl)benzo[d]oxazole | US10...)
Show SMILES CC(C)CCc1nc2cc(ccc2o1)-c1ccncc1
Show InChI InChI=1S/C17H18N2O/c1-12(2)3-6-17-19-15-11-14(4-5-16(15)20-17)13-7-9-18-10-8-13/h4-5,7-12H,3,6H2,1-2H3
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279499
PNG
(2-(2,2-dimethylcyclopropyl)-6-(pyridin-4-yl)-1H-be...)
Show SMILES CC1(C)CC1C(=O)Nc1ccc(cc1N)-c1ccncc1
Show InChI InChI=1S/C17H19N3O/c1-17(2)10-13(17)16(21)20-15-4-3-12(9-14(15)18)11-5-7-19-8-6-11/h3-9,13H,10,18H2,1-2H3,(H,20,21)
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279526
PNG
(3-fluoro-3-methyl-1-(5-(pyridin-4-yl)-1H-benzo[d]i...)
Show SMILES CC(C)(F)CC(N)c1nc2cc(ccc2[nH]1)-c1ccncc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279475
PNG
(2-isopentyl-4-methoxy-6-(pyridin-4-yl)-1H-benzo[d]...)
Show SMILES COc1cc(cc2[nH]c(CCC(C)C)nc12)-c1ccncc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279554
PNG
(4,4,4-trifluoro-1-(6-(oxazol-5-yl)-1H-benzo[d]imid...)
Show SMILES NC(CC(C(F)(F)F)C(F)(F)F)c1nc2ccc(cc2[nH]1)-c1cnco1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279541
PNG
(4,4,4-trifluoro-1-(5-(pyridin-4-yl)benzo[d]oxazol-...)
Show SMILES NC(CC(C(F)(F)F)C(F)(F)F)c1nc2cc(ccc2o1)-c1ccncc1
Show InChI InChI=1S/C17H13F6N3O/c18-16(19,20)14(17(21,22)23)8-11(24)15-26-12-7-10(1-2-13(12)27-15)9-3-5-25-6-4-9/h1-7,11,14H,8,24H2
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279559
PNG
((R)-N,3-dimethyl-1-(5-(pyridazin-4-yl)-1H-benzo[d]...)
Show SMILES CNC(CC(C)C)c1nc2cc(ccc2[nH]1)-c1ccnnc1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279527
PNG
((R)-(5-(pyridin-4-yl)-1H-benzo[d]imidazol-2-yl) (t...)
Show SMILES CC(C)(C)OC(=O)N[C@H](C1CCOCC1)C(=O)Nc1ccc(Br)cc1N
Show InChI InChI=1S/C18H26BrN3O4/c1-18(2,3)26-17(24)22-15(11-6-8-25-9-7-11)16(23)21-14-5-4-12(19)10-13(14)20/h4-5,10-11,15H,6-9,20H2,1-3H3,(H,21,23)(H,22,24)/t15-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279534
PNG
(3-methyl-1-(6-(pyridin-4-yl)benzo[d]oxazol-2-yl)bu...)
Show SMILES CC(C)CC(N)c1nc2ccc(cc2o1)-c1ccncc1
Show InChI InChI=1S/C17H19N3O/c1-11(2)9-14(18)17-20-15-4-3-13(10-16(15)21-17)12-5-7-19-8-6-12/h3-8,10-11,14H,9,18H2,1-2H3
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279482
PNG
((R)-1-(1-ethyl-6-(oxazol-5-yl)-1H-benzo[d]imidazol...)
Show SMILES CCn1c(nc2ccc(cc12)-c1cnco1)[C@H](N)CC(C)C
Show InChI InChI=1S/C17H22N4O/c1-4-21-15-8-12(16-9-19-10-22-16)5-6-14(15)20-17(21)13(18)7-11(2)3/h5-6,8-11,13H,4,7,18H2,1-3H3/t13-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279497
PNG
((R)-1-(5-methoxy-6-(pyridin-4-yl)-1H-benzo[d]imida...)
Show SMILES COc1cc(N)c(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1Br
Show InChI InChI=1S/C21H26BrN3O4/c1-13(2)9-18(25-21(27)29-12-14-7-5-4-6-8-14)20(26)24-17-10-15(22)19(28-3)11-16(17)23/h4-8,10-11,13,18H,9,12,23H2,1-3H3,(H,24,26)(H,25,27)/t18-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279470
PNG
((R)-1-(5-(5-fluoro-2-methoxypyridin-4-yl)-1H-benzo...)
Show SMILES COc1cc(c(F)cn1)-c1ccc2[nH]c(nc2c1)[C@H](N)CC(C)C
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279528
PNG
((R)-1-(5-(3,5-dimethylisoxazol-4-yl)-1H-benzo[d]im...)
Show SMILES CC(C)C[C@@H](NC(=O)OC(C)(C)C)c1nc2cc(ccc2[nH]1)-c1c(C)noc1C
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279503
PNG
(3,3,3-trifluoro-2-methyl-1-(6-(pyridin-4-yl)-1H-be...)
Show SMILES CC(C(N)c1nc2ccc(cc2[nH]1)-c1ccncc1)C(F)(F)F
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279488
PNG
((R)-1-(1-(2-methoxyethyl)-6-(pyridin-4-yl)-1H-benz...)
Show SMILES COCCn1c(nc2ccc(cc12)-c1ccncc1)[C@H](N)CC(C)C
Show InChI InChI=1S/C20H26N4O/c1-14(2)12-17(21)20-23-18-5-4-16(15-6-8-22-9-7-15)13-19(18)24(20)10-11-25-3/h4-9,13-14,17H,10-12,21H2,1-3H3/t17-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279473
PNG
((R)-1-(7-methoxy-5-(3-methoxypyridin-4-yl)-1H-benz...)
Show SMILES COc1cnccc1-c1cc(OC)c2[nH]c(nc2c1)[C@H](N)CC(C)C
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279491
PNG
((R)-2-(2-(1-amino-3-methylbutyl)-6-(oxazol-5-yl)-1...)
Show SMILES CC(C)C[C@@H](N)c1nc2ccc(cc2n1CCO)-c1cnco1
Show InChI InChI=1S/C17H22N4O2/c1-11(2)7-13(18)17-20-14-4-3-12(16-9-19-10-23-16)8-15(14)21(17)5-6-22/h3-4,8-11,13,22H,5-7,18H2,1-2H3/t13-/m1/s1
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279529
PNG
(4-(1-(5-bromo-1H-benzo[d]imidazol-2-yl) ethyl) mor...)
Show SMILES CC(N1CCOCC1)C(=O)Nc1ccc(Br)cc1N
Show InChI InChI=1S/C13H18BrN3O2/c1-9(17-4-6-19-7-5-17)13(18)16-12-3-2-10(14)8-11(12)15/h2-3,8-9H,4-7,15H2,1H3,(H,16,18)
PDB

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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279506
PNG
(2-isopentyl-5-(3-methoxypyridin-4-yl)-1H-benzo[d]i...)
Show SMILES COc1cnccc1-c1ccc2[nH]c(CCC(C)C)nc2c1
PDB

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n/an/a 620n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279552
PNG
((R)-N-(2-methoxyethyl)-3-methyl-1-(5-(oxazol-5-yl)...)
Show SMILES COCCN[C@H](CC(C)C)c1nc2cc(ccc2[nH]1)-c1cnco1
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n/an/a 680n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279530
PNG
((R)-2,2,2-trifluoro-N-(3-methyl-1-(5-(pyridin-4-yl...)
Show SMILES CC(C)C[C@@H](NC(=O)OC(C)(C)C)c1nc2cc(ccc2[nH]1)-c1ccncc1
PDB

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n/an/a 697n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279495
PNG
((R)-1-(1-ethyl-5-(pyridin-4-yl)-1H-benzo[d]imidazo...)
Show SMILES CCn1c(nc2cc(ccc12)-c1ccncc1)[C@H](N)CC(C)C
Show InChI InChI=1S/C19H24N4/c1-4-23-18-6-5-15(14-7-9-21-10-8-14)12-17(18)22-19(23)16(20)11-13(2)3/h5-10,12-13,16H,4,11,20H2,1-3H3/t16-/m1/s1
PDB

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n/an/a 749n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279501
PNG
(1-isopropyl-4-(6-(pyridin-4-yl)-1H-benzo[d]imidazo...)
Show SMILES CC(C)N1CC(CC1=O)C(=O)Nc1ccc(cc1N)-c1ccncc1
Show InChI InChI=1S/C19H22N4O2/c1-12(2)23-11-15(10-18(23)24)19(25)22-17-4-3-14(9-16(17)20)13-5-7-21-8-6-13/h3-9,12,15H,10-11,20H2,1-2H3,(H,22,25)
PDB

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n/an/a 783n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279504
PNG
(2-(isopropoxymethyl)-6-(pyridin-4-yl)-1H-benzo[d]i...)
Show SMILES CC(C)OCC(=O)Nc1ccc(cc1N)-c1ccncc1
Show InChI InChI=1S/C16H19N3O2/c1-11(2)21-10-16(20)19-15-4-3-13(9-14(15)17)12-5-7-18-8-6-12/h3-9,11H,10,17H2,1-2H3,(H,19,20)
PDB

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n/an/a 785n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279546
PNG
((R)-3-methyl-1-(5-(pyridin-4-yl)benzo[d]thiazol-2-...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2s1)-c1ccncc1
Show InChI InChI=1S/C17H19N3S/c1-11(2)9-14(18)17-20-15-10-13(3-4-16(15)21-17)12-5-7-19-8-6-12/h3-8,10-11,14H,9,18H2,1-2H3/t14-/m1/s1
PDB

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n/an/a 797n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279540
PNG
(2-(cyclopentylmethyl)-5-(pyridin-4-yl)benzo[d]oxaz...)
Show SMILES C(C1CCCC1)c1nc2cc(ccc2o1)-c1ccncc1
Show InChI InChI=1S/C18H18N2O/c1-2-4-13(3-1)11-18-20-16-12-15(5-6-17(16)21-18)14-7-9-19-10-8-14/h5-10,12-13H,1-4,11H2
PDB

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n/an/a 818n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279535
PNG
(2-isopentyl-6-(pyridin-4-yl)benzo[d]oxazole | US10...)
Show SMILES CC(C)CCc1nc2ccc(cc2o1)-c1ccncc1
Show InChI InChI=1S/C17H18N2O/c1-12(2)3-6-17-19-15-5-4-14(11-16(15)20-17)13-7-9-18-10-8-13/h4-5,7-12H,3,6H2,1-2H3
PDB

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n/an/a 833n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279498
PNG
(2-(2-methylcyclopropyl)-6-(pyridin-4-yl)-1H-benzo[...)
Show SMILES CC1CC1c1nc2ccc(cc2[nH]1)-c1ccncc1
PDB

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n/an/a 897n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279550
PNG
(2-isopentyl-6-(oxazol-5-yl)benzo[d]oxazole | US100...)
Show SMILES [O-][N+](=O)c1ccc(cc1Br)-c1cnco1
Show InChI InChI=1S/C9H5BrN2O3/c10-7-3-6(9-4-11-5-15-9)1-2-8(7)12(13)14/h1-5H
PDB

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n/an/a 1.02E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279531
PNG
(2-(3-methylcyclohexyl)-6-(pyridin-4-yl)-1H-benzo[d...)
Show SMILES CC1CCCC(C1)C(=O)Nc1ccc(Br)cc1N
Show InChI InChI=1S/C14H19BrN2O/c1-9-3-2-4-10(7-9)14(18)17-13-6-5-11(15)8-12(13)16/h5-6,8-10H,2-4,7,16H2,1H3,(H,17,18)
PDB

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n/an/a 1.43E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279496
PNG
((R)-1-(1-ethyl-5-(oxazol-5-yl)-1H-benzo[d]imidazol...)
Show SMILES CCn1c(nc2cc(ccc12)-c1cnco1)[C@H](N)CC(C)C
Show InChI InChI=1S/C17H22N4O/c1-4-21-15-6-5-12(16-9-19-10-22-16)8-14(15)20-17(21)13(18)7-11(2)3/h5-6,8-11,13H,4,7,18H2,1-3H3/t13-/m1/s1
PDB

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n/an/a 1.54E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279507
PNG
(2-isopentyl-5-(2-methoxypyridin-4-yl)-1H-benzo[d]i...)
Show SMILES COc1cc(ccn1)-c1ccc2[nH]c(CCC(C)C)nc2c1
PDB

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n/an/a 1.55E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279474
PNG
((R)-1-(7-methoxy-5-(2-methoxypyridin-4-yl)-1H-benz...)
Show SMILES COc1cc(ccn1)-c1cc(OC)c2[nH]c(nc2c1)[C@H](N)CC(C)C
PDB

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n/an/a 1.59E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279542
PNG
(2-(2-cyclopentylethyl)-5-(pyridin-4-yl)benzo[d]oxa...)
Show SMILES C(Cc1nc2cc(ccc2o1)-c1ccncc1)C1CCCC1
Show InChI InChI=1S/C19H20N2O/c1-2-4-14(3-1)5-8-19-21-17-13-16(6-7-18(17)22-19)15-9-11-20-12-10-15/h6-7,9-14H,1-5,8H2
PDB

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n/an/a 1.70E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279500
PNG
(2-(3-(tert-butyl)-1-methyl-1H-pyrazol-5-yl)-6-(pyr...)
Show SMILES Cn1nc(cc1C(=O)Nc1ccc(cc1N)-c1ccncc1)C(C)(C)C
Show InChI InChI=1S/C20H23N5O/c1-20(2,3)18-12-17(25(4)24-18)19(26)23-16-6-5-14(11-15(16)21)13-7-9-22-10-8-13/h5-12H,21H2,1-4H3,(H,23,26)
PDB

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n/an/a 1.73E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279505
PNG
(2-(tert-butoxymethyl)-6-(pyridin-4-yl)-1H-benzo[d]...)
Show SMILES CC(C)(C)OCC(=O)Nc1ccc(cc1N)-c1ccncc1
Show InChI InChI=1S/C17H21N3O2/c1-17(2,3)22-11-16(21)20-15-5-4-13(10-14(15)18)12-6-8-19-9-7-12/h4-10H,11,18H2,1-3H3,(H,20,21)
PDB

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n/an/a 1.79E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279532
PNG
((R)-cyclopentyl(6-methoxy-5-(pyridin-4-yl)-1H-benz...)
Show SMILES COc1cc2[nH]c(nc2cc1-c1ccncc1)[C@H](NC(=O)OC(C)(C)C)C1CCCC1
PDB

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n/an/a 1.80E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279477
PNG
((R)-1-(6-methoxy-5-(3-methoxypyridin-4-yl)-1H-benz...)
Show SMILES COc1cnccc1-c1cc2nc([nH]c2cc1OC)[C@H](N)CC(C)C
PDB

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n/an/a 2.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279478
PNG
((R)-1-(6-methoxy-5-(2-methoxypyridin-4-yl)-1H-benz...)
Show SMILES COc1cc(ccn1)-c1cc2nc([nH]c2cc1OC)[C@H](N)CC(C)C
PDB

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n/an/a 2.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279536
PNG
((E)-2-(4-m ethylpent-2-en-2-yl)-5-(pyridin-4-yl)be...)
Show SMILES CC(C)\C=C(/C)c1nc2cc(ccc2o1)-c1ccncc1
Show InChI InChI=1S/C18H18N2O/c1-12(2)10-13(3)18-20-16-11-15(4-5-17(16)21-18)14-6-8-19-9-7-14/h4-12H,1-3H3/b13-10+
PDB

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n/an/a 2.31E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279467
PNG
((R)-1-(5-(2, 6-difluoropyridin-4-yl)-1H-benzo[d]im...)
Show SMILES CC(C)C[C@@H](N)c1nc2cc(ccc2[nH]1)-c1cc(F)nc(F)c1
PDB

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n/an/a 3.94E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

More data for this
Ligand-Target Pair
AP2-associated protein kinase 1


(Homo sapiens)
BDBM279489
PNG
((R)-1-(1-(2-methoxyethyl)-6-(oxazol-5-yl)-1H-benzo...)
Show SMILES COCCn1c(nc2ccc(cc12)-c1cnco1)[C@H](N)CC(C)C
Show InChI InChI=1S/C18H24N4O2/c1-12(2)8-14(19)18-21-15-5-4-13(17-10-20-11-24-17)9-16(15)22(18)6-7-23-3/h4-5,9-12,14H,6-8,19H2,1-3H3/t14-/m1/s1
PDB

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n/an/a 6.74E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US10035777 (2018)

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