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126 similar compounds to monomer 98199

Compile data set for download or QSAR
Wt: 384.4
BDBM98190
Wt: 342.3
BDBM98191
Wt: 370.4
BDBM98192
Wt: 330.3
BDBM98194
Wt: 344.4
BDBM98195
Wt: 386.4
BDBM98196
Wt: 358.4
BDBM98197
Wt: 399.4
BDBM98201
Wt: 392.4
BDBM98202
Wt: 386.4
BDBM98260
Wt: 404.4
BDBM98261
Wt: 416.4
BDBM98262
Wt: 392.4
BDBM98268
Wt: 362.4
BDBM98270
Wt: 348.4
BDBM98271
Displayed 1 to 15 (of 126 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 98190,98191,98192,98194,98195,98196,98197,98201,98202,98260,98261,98262,98268,98270,98271   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98190
PNG
(US8481733, 1)
Show SMILES Nc1nccn2c(nc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCCCC1
Show InChI InChI=1S/C24H24N4O/c25-23-22-21(17-11-13-20(14-12-17)29-19-9-5-2-6-10-19)27-24(28(22)16-15-26-23)18-7-3-1-4-8-18/h2,5-6,9-16,18H,1,3-4,7-8H2,(H2,25,26)
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n/an/a 989n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98260
PNG
(US8481733, 72)
Show SMILES COc1cc(Oc2ccccc2)ccc1-c1nc(C2CCC2)n2ccnc(N)c12
Show InChI InChI=1S/C23H22N4O2/c1-28-19-14-17(29-16-8-3-2-4-9-16)10-11-18(19)20-21-22(24)25-12-13-27(21)23(26-20)15-6-5-7-15/h2-4,8-15H,5-7H2,1H3,(H2,24,25)
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n/an/a 75n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of ACK1 (unknown origin) by biochemical assay


Bioorg Med Chem Lett 23: 979-84 (2013)


Article DOI: 10.1016/j.bmcl.2012.12.042
BindingDB Entry DOI: 10.7270/Q2348MQT
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98192
PNG
(US8481733, 3)
Show SMILES Nc1nccn2c(nc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCCC1
Show InChI InChI=1S/C23H22N4O/c24-22-21-20(26-23(17-6-4-5-7-17)27(21)15-14-25-22)16-10-12-19(13-11-16)28-18-8-2-1-3-9-18/h1-3,8-15,17H,4-7H2,(H2,24,25)
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n/an/a 212n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98194
PNG
(US8481733, 5)
Show SMILES CCc1nc(-c2ccc(Oc3ccccc3)cc2)c2c(N)nccn12
Show InChI InChI=1S/C20H18N4O/c1-2-17-23-18(19-20(21)22-12-13-24(17)19)14-8-10-16(11-9-14)25-15-6-4-3-5-7-15/h3-13H,2H2,1H3,(H2,21,22)
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n/an/a 358n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98195
PNG
(US8481733, 6)
Show SMILES CC(C)c1nc(-c2ccc(Oc3ccccc3)cc2)c2c(N)nccn12
Show InChI InChI=1S/C21H20N4O/c1-14(2)21-24-18(19-20(22)23-12-13-25(19)21)15-8-10-17(11-9-15)26-16-6-4-3-5-7-16/h3-14H,1-2H3,(H2,22,23)
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n/an/a 95.8n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98196
PNG
(US8481733, 7)
Show SMILES Nc1nccn2c(nc(-c3ccc(Oc4ccccc4)cc3)c12)C1CCOCC1
Show InChI InChI=1S/C23H22N4O2/c24-22-21-20(16-6-8-19(9-7-16)29-18-4-2-1-3-5-18)26-23(27(21)13-12-25-22)17-10-14-28-15-11-17/h1-9,12-13,17H,10-11,14-15H2,(H2,24,25)
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n/an/a 2.07E+3n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98197
PNG
(US8481733, 8)
Show SMILES CC(C)(C)c1nc(-c2ccc(Oc3ccccc3)cc2)c2c(N)nccn12
Show InChI InChI=1S/C22H22N4O/c1-22(2,3)21-25-18(19-20(23)24-13-14-26(19)21)15-9-11-17(12-10-15)27-16-7-5-4-6-8-16/h4-14H,1-3H3,(H2,23,24)
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n/an/a 330n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98201
PNG
(US8481733, 12)
Show SMILES CN(C)[C@H]1C[C@H](C1)c1nc(-c2ccc(Oc3ccccc3)cc2)c2c(N)nccn12
Show InChI InChI=1S/C24H25N5O/c1-28(2)18-14-17(15-18)24-27-21(22-23(25)26-12-13-29(22)24)16-8-10-20(11-9-16)30-19-6-4-3-5-7-19/h3-13,17-18H,14-15H2,1-2H3,(H2,25,26)/t17-,18+
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n/an/a 1.53E+3n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98202
PNG
(US8481733, 13)
Show SMILES Nc1nccn2c(nc(-c3ccc(Oc4ccccc4)cc3)c12)C1CC(F)(F)C1
Show InChI InChI=1S/C22H18F2N4O/c23-22(24)12-15(13-22)21-27-18(19-20(25)26-10-11-28(19)21)14-6-8-17(9-7-14)29-16-4-2-1-3-5-16/h1-11,15H,12-13H2,(H2,25,26)
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n/an/a 1.15E+3n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98260
PNG
(US8481733, 72)
Show SMILES COc1cc(Oc2ccccc2)ccc1-c1nc(C2CCC2)n2ccnc(N)c12
Show InChI InChI=1S/C23H22N4O2/c1-28-19-14-17(29-16-8-3-2-4-9-16)10-11-18(19)20-21-22(24)25-12-13-27(21)23(26-20)15-6-5-7-15/h2-4,8-15H,5-7H2,1H3,(H2,24,25)
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n/an/a 75n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98261
PNG
(US8481733, 205 | US8481733, 271 | US8481733, 73)
Show SMILES COc1cccc(F)c1Oc1ccc(cc1)-c1nc(C2CCC2)n2ccnc(N)c12
Show InChI InChI=1S/C23H21FN4O2/c1-29-18-7-3-6-17(24)21(18)30-16-10-8-14(9-11-16)19-20-22(25)26-12-13-28(20)23(27-19)15-4-2-5-15/h3,6-13,15H,2,4-5H2,1H3,(H2,25,26)
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n/an/a 2.50E+3n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98262
PNG
(US8481733, 74)
Show SMILES COc1cc(cc(OC)c1Oc1ccccc1)-c1nc(C2CCC2)n2ccnc(N)c12
Show InChI InChI=1S/C24H24N4O3/c1-29-18-13-16(14-19(30-2)22(18)31-17-9-4-3-5-10-17)20-21-23(25)26-11-12-28(21)24(27-20)15-7-6-8-15/h3-5,9-15H,6-8H2,1-2H3,(H2,25,26)
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n/an/a 770n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98268
PNG
(US8481733, 80)
Show SMILES Nc1nccn2c(nc(-c3ccc(Oc4c(F)cccc4F)cc3)c12)C1CCC1
Show InChI InChI=1S/C22H18F2N4O/c23-16-5-2-6-17(24)20(16)29-15-9-7-13(8-10-15)18-19-21(25)26-11-12-28(19)22(27-18)14-3-1-4-14/h2,5-12,14H,1,3-4H2,(H2,25,26)
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n/an/a 320n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98270
PNG
(US8481733, 82)
Show SMILES Nc1nccn2c(nc(-c3ccc(OC4CCCCC4)cc3)c12)C1CCC1
Show InChI InChI=1S/C22H26N4O/c23-21-20-19(25-22(16-5-4-6-16)26(20)14-13-24-21)15-9-11-18(12-10-15)27-17-7-2-1-3-8-17/h9-14,16-17H,1-8H2,(H2,23,24)
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n/an/a 800n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98271
PNG
(US8481733, 83)
Show SMILES Nc1nccn2c(nc(-c3ccc(OC4CCCC4)cc3)c12)C1CCC1
Show InChI InChI=1S/C21H24N4O/c22-20-19-18(24-21(15-4-3-5-15)25(19)13-12-23-20)14-8-10-17(11-9-14)26-16-6-1-2-7-16/h8-13,15-16H,1-7H2,(H2,22,23)
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n/an/a 5.19E+3n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98261
PNG
(US8481733, 205 | US8481733, 271 | US8481733, 73)
Show SMILES COc1cccc(F)c1Oc1ccc(cc1)-c1nc(C2CCC2)n2ccnc(N)c12
Show InChI InChI=1S/C23H21FN4O2/c1-29-18-7-3-6-17(24)21(18)30-16-10-8-14(9-11-16)19-20-22(25)26-12-13-28(20)23(27-19)15-4-2-5-15/h3,6-13,15H,2,4-5H2,1H3,(H2,25,26)
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n/an/a 2.53E+3n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM98191
PNG
(US8481733, 2)
Show SMILES Nc1nccn2c(nc(-c3ccc(Oc4ccccc4)cc3)c12)C1CC1
Show InChI InChI=1S/C21H18N4O/c22-20-19-18(24-21(15-6-7-15)25(19)13-12-23-20)14-8-10-17(11-9-14)26-16-4-2-1-3-5-16/h1-5,8-13,15H,6-7H2,(H2,22,23)
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n/an/a 271n/an/an/an/an/an/a



OSI Pharmaceuticals LLC

US Patent


Assay Description
AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.


US Patent US8481733 (2013)


BindingDB Entry DOI: 10.7270/Q2XD109J
More data for this
Ligand-Target Pair