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PubMed code 19648005

Compile data set for download or QSAR
Found 41 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
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301365
PNG
(CHEMBL570365 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccnc4)nc3)c2cc1OC
Show InChI InChI=1S/C33H25N5O5/c1-41-29-16-25-27(17-30(29)42-2)35-14-12-28(25)43-24-10-11-31(36-19-24)37-32(39)26-15-22(21-7-6-13-34-18-21)20-38(33(26)40)23-8-4-3-5-9-23/h3-20H,1-2H3,(H,36,37,39)
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n/an/a 33n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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n/an/a 35n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301359
PNG
(CHEMBL570846 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4c(NC5CCOCC5)ccn(-c5ccccc5)c4=O)nc3)c2cc1OC
Show InChI InChI=1S/C33H31N5O6/c1-41-28-18-24-26(19-29(28)42-2)34-14-10-27(24)44-23-8-9-30(35-20-23)37-32(39)31-25(36-21-12-16-43-17-13-21)11-15-38(33(31)40)22-6-4-3-5-7-22/h3-11,14-15,18-21,36H,12-13,16-17H2,1-2H3,(H,35,37,39)
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n/an/a 44n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301366
PNG
(5-benzyl-N-(5-(6,7-dimethoxyquinolin-4-yloxy)pyrid...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(Cc5ccccc5)cn(-c5ccccc5)c4=O)nc3)c2cc1OC
Show InChI InChI=1S/C35H28N4O5/c1-42-31-19-27-29(20-32(31)43-2)36-16-15-30(27)44-26-13-14-33(37-21-26)38-34(40)28-18-24(17-23-9-5-3-6-10-23)22-39(35(28)41)25-11-7-4-8-12-25/h3-16,18-22H,17H2,1-2H3,(H,37,38,40)
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n/an/a 49n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human PyK2 Y402 autophosphorylation expressed in 293T cells by immunofluorescence assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301358
PNG
(CHEMBL568729 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COCCNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C31H29N5O6/c1-39-16-14-33-23-12-15-36(20-7-5-4-6-8-20)31(38)29(23)30(37)35-28-10-9-21(19-34-28)42-25-11-13-32-24-18-27(41-3)26(40-2)17-22(24)25/h4-13,15,17-19,33H,14,16H2,1-3H3,(H,34,35,37)
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n/an/a 50n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301364
PNG
(CHEMBL570380 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccs4)nc3)c2cc1OC
Show InChI InChI=1S/C32H24N4O5S/c1-39-27-16-23-25(17-28(27)40-2)33-13-12-26(23)41-22-10-11-30(34-18-22)35-31(37)24-15-20(29-9-6-14-42-29)19-36(32(24)38)21-7-4-3-5-8-21/h3-19H,1-2H3,(H,34,35,37)
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n/an/a 53n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human PyK2 Y402 autophosphorylation expressed in 293T cells by immunofluorescence assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301362
PNG
(4-(2-methoxyethylamino)-N-(5-(7-methoxyquinolin-4-...)
Show SMILES COCCNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)ccc23)cn1
Show InChI InChI=1S/C30H27N5O5/c1-38-17-15-32-24-13-16-35(20-6-4-3-5-7-20)30(37)28(24)29(36)34-27-11-9-22(19-33-27)40-26-12-14-31-25-18-21(39-2)8-10-23(25)26/h3-14,16,18-19,32H,15,17H2,1-2H3,(H,33,34,36)
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n/an/a 120n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301363
PNG
(1-benzyl-N-(5-(6,7-dimethoxyquinolin-4-yloxy)pyrid...)
Show SMILES CNc1ccn(Cc2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C30H27N5O5/c1-31-22-12-14-35(18-19-7-5-4-6-8-19)30(37)28(22)29(36)34-27-10-9-20(17-33-27)40-24-11-13-32-23-16-26(39-3)25(38-2)15-21(23)24/h4-17,31H,18H2,1-3H3,(H,33,34,36)
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n/an/a 170n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301357
PNG
(CHEMBL572237 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4c(ccn(-c5ccccc5)c4=O)N(C)C)nc3)c2cc1OC
Show InChI InChI=1S/C30H27N5O5/c1-34(2)23-13-15-35(19-8-6-5-7-9-19)30(37)28(23)29(36)33-27-11-10-20(18-32-27)40-24-12-14-31-22-17-26(39-4)25(38-3)16-21(22)24/h5-18H,1-4H3,(H,32,33,36)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301366
PNG
(5-benzyl-N-(5-(6,7-dimethoxyquinolin-4-yloxy)pyrid...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(Cc5ccccc5)cn(-c5ccccc5)c4=O)nc3)c2cc1OC
Show InChI InChI=1S/C35H28N4O5/c1-42-31-19-27-29(20-32(31)43-2)36-16-15-30(27)44-26-13-14-33(37-21-26)38-34(40)28-18-24(17-23-9-5-3-6-10-23)22-39(35(28)41)25-11-7-4-8-12-25/h3-16,18-22H,17H2,1-2H3,(H,37,38,40)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human PyK2 Y402 autophosphorylation expressed in 293T cells by immunofluorescence assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301367
PNG
(CHEMBL570381 | N-(5-(7-methoxyquinolin-4-yloxy)pyr...)
Show SMILES COc1ccc2c(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccnc4)nc3)ccnc2c1
Show InChI InChI=1S/C32H23N5O4/c1-40-24-9-11-26-28(17-24)34-15-13-29(26)41-25-10-12-30(35-19-25)36-31(38)27-16-22(21-6-5-14-33-18-21)20-37(32(27)39)23-7-3-2-4-8-23/h2-20H,1H3,(H,35,36,38)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2


(Homo sapiens (Human))
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of TYK2


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Pancreatic endoplasmic reticulum kinase (PERK)


(Homo sapiens (Human))
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of PEK


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Jak1


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Jak3


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Jak2


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Interferon-induced, double-stranded RNA-activated protein kinase


(Homo sapiens (Human))
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of PKR


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301368
PNG
(CHEMBL570189 | N-(5-(7-methoxyquinolin-4-yloxy)pyr...)
Show SMILES COc1ccc2c(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cnccn4)nc3)ccnc2c1
Show InChI InChI=1S/C31H22N6O4/c1-40-22-7-9-24-26(16-22)33-12-11-28(24)41-23-8-10-29(35-17-23)36-30(38)25-15-20(27-18-32-13-14-34-27)19-37(31(25)39)21-5-3-2-4-6-21/h2-19H,1H3,(H,35,36,38)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301364
PNG
(CHEMBL570380 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccs4)nc3)c2cc1OC
Show InChI InChI=1S/C32H24N4O5S/c1-39-27-16-23-25(17-28(27)40-2)33-13-12-26(23)41-22-10-11-30(34-18-22)35-31(37)24-15-20(29-9-6-14-42-29)19-36(32(24)38)21-7-4-3-5-8-21/h3-19H,1-2H3,(H,34,35,37)
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n/an/a 1.12E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human PyK2 Y402 autophosphorylation expressed in 293T cells by immunofluorescence assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301359
PNG
(CHEMBL570846 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4c(NC5CCOCC5)ccn(-c5ccccc5)c4=O)nc3)c2cc1OC
Show InChI InChI=1S/C33H31N5O6/c1-41-28-18-24-26(19-29(28)42-2)34-14-10-27(24)44-23-8-9-30(35-20-23)37-32(39)31-25(36-21-12-16-43-17-13-21)11-15-38(33(31)40)22-6-4-3-5-7-22/h3-11,14-15,18-21,36H,12-13,16-17H2,1-2H3,(H,35,37,39)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301361
PNG
(CHEMBL570647 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4c(Nc5ccccc5)ccn(-c5ccccc5)c4=O)nc3)c2cc1OC
Show InChI InChI=1S/C34H27N5O5/c1-42-29-19-25-27(20-30(29)43-2)35-17-15-28(25)44-24-13-14-31(36-21-24)38-33(40)32-26(37-22-9-5-3-6-10-22)16-18-39(34(32)41)23-11-7-4-8-12-23/h3-21,37H,1-2H3,(H,36,38,40)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301358
PNG
(CHEMBL568729 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COCCNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C31H29N5O6/c1-39-16-14-33-23-12-15-36(20-7-5-4-6-8-20)31(38)29(23)30(37)35-28-10-9-21(19-34-28)42-25-11-13-32-24-18-27(41-3)26(40-2)17-22(24)25/h4-13,15,17-19,33H,14,16H2,1-3H3,(H,34,35,37)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301366
PNG
(5-benzyl-N-(5-(6,7-dimethoxyquinolin-4-yloxy)pyrid...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(Cc5ccccc5)cn(-c5ccccc5)c4=O)nc3)c2cc1OC
Show InChI InChI=1S/C35H28N4O5/c1-42-31-19-27-29(20-32(31)43-2)36-16-15-30(27)44-26-13-14-33(37-21-26)38-34(40)28-18-24(17-23-9-5-3-6-10-23)22-39(35(28)41)25-11-7-4-8-12-25/h3-16,18-22H,17H2,1-2H3,(H,37,38,40)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B)


(Homo sapiens (Human))
BDBM50301360
PNG
(CHEMBL570643 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4c(ccn(-c5ccccc5)c4=O)N4CCN(C)CC4)nc3)c2cc1OC
Show InChI InChI=1S/C33H32N6O5/c1-37-15-17-38(18-16-37)26-12-14-39(22-7-5-4-6-8-22)33(41)31(26)32(40)36-30-10-9-23(21-35-30)44-27-11-13-34-25-20-29(43-3)28(42-2)19-24(25)27/h4-14,19-21H,15-18H2,1-3H3,(H,35,36,40)
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n/an/a 2.80E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Pyk2 by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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n/an/a 1.70E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301361
PNG
(CHEMBL570647 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4c(Nc5ccccc5)ccn(-c5ccccc5)c4=O)nc3)c2cc1OC
Show InChI InChI=1S/C34H27N5O5/c1-42-29-19-25-27(20-30(29)43-2)35-17-15-28(25)44-24-13-14-31(36-21-24)38-33(40)32-26(37-22-9-5-3-6-10-22)16-18-39(34(32)41)23-11-7-4-8-12-23/h3-21,37H,1-2H3,(H,36,38,40)
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n/an/a 1.80E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301362
PNG
(4-(2-methoxyethylamino)-N-(5-(7-methoxyquinolin-4-...)
Show SMILES COCCNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)ccc23)cn1
Show InChI InChI=1S/C30H27N5O5/c1-38-17-15-32-24-13-16-35(20-6-4-3-5-7-20)30(37)28(24)29(36)34-27-11-9-22(19-33-27)40-26-12-14-31-25-18-21(39-2)8-10-23(25)26/h3-14,16,18-19,32H,15,17H2,1-2H3,(H,33,34,36)
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n/an/a>1.25E+5n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301368
PNG
(CHEMBL570189 | N-(5-(7-methoxyquinolin-4-yloxy)pyr...)
Show SMILES COc1ccc2c(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cnccn4)nc3)ccnc2c1
Show InChI InChI=1S/C31H22N6O4/c1-40-22-7-9-24-26(16-22)33-12-11-28(24)41-23-8-10-29(35-17-23)36-30(38)25-15-20(27-18-32-13-14-34-27)19-37(31(25)39)21-5-3-2-4-6-21/h2-19H,1H3,(H,35,36,38)
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n/an/a>1.25E+5n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301360
PNG
(CHEMBL570643 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4c(ccn(-c5ccccc5)c4=O)N4CCN(C)CC4)nc3)c2cc1OC
Show InChI InChI=1S/C33H32N6O5/c1-37-15-17-38(18-16-37)26-12-14-39(22-7-5-4-6-8-22)33(41)31(26)32(40)36-30-10-9-23(21-35-30)44-27-11-13-34-25-20-29(43-3)28(42-2)19-24(25)27/h4-14,19-21H,15-18H2,1-3H3,(H,35,36,40)
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n/an/a>1.25E+5n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301357
PNG
(CHEMBL572237 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4c(ccn(-c5ccccc5)c4=O)N(C)C)nc3)c2cc1OC
Show InChI InChI=1S/C30H27N5O5/c1-34(2)23-13-15-35(19-8-6-5-7-9-19)30(37)28(23)29(36)33-27-11-10-20(18-32-27)40-24-12-14-31-22-17-26(39-4)25(38-3)16-21(22)24/h5-18H,1-4H3,(H,32,33,36)
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n/an/a>1.25E+5n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301364
PNG
(CHEMBL570380 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccs4)nc3)c2cc1OC
Show InChI InChI=1S/C32H24N4O5S/c1-39-27-16-23-25(17-28(27)40-2)33-13-12-26(23)41-22-10-11-30(34-18-22)35-31(37)24-15-20(29-9-6-14-42-29)19-36(32(24)38)21-7-4-3-5-8-21/h3-19H,1-2H3,(H,34,35,37)
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n/an/a>1.25E+5n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301367
PNG
(CHEMBL570381 | N-(5-(7-methoxyquinolin-4-yloxy)pyr...)
Show SMILES COc1ccc2c(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccnc4)nc3)ccnc2c1
Show InChI InChI=1S/C32H23N5O4/c1-40-24-9-11-26-28(17-24)34-15-13-29(26)41-25-10-12-30(35-19-25)36-31(38)27-16-22(21-6-5-14-33-18-21)20-37(32(27)39)23-7-3-2-4-8-23/h2-20H,1H3,(H,35,36,38)
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n/an/a>1.25E+5n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301363
PNG
(1-benzyl-N-(5-(6,7-dimethoxyquinolin-4-yloxy)pyrid...)
Show SMILES CNc1ccn(Cc2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C30H27N5O5/c1-31-22-12-14-35(18-19-7-5-4-6-8-19)30(37)28(22)29(36)34-27-10-9-20(17-33-27)40-24-11-13-32-23-16-26(39-3)25(38-2)15-21(23)24/h4-17,31H,18H2,1-3H3,(H,33,34,36)
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n/an/a>1.25E+5n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50301365
PNG
(CHEMBL570365 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccnc4)nc3)c2cc1OC
Show InChI InChI=1S/C33H25N5O5/c1-41-29-16-25-27(17-30(29)42-2)35-14-12-28(25)43-24-10-11-31(36-19-24)37-32(39)26-15-22(21-7-6-13-34-18-21)20-38(33(26)40)23-8-4-3-5-9-23/h3-20H,1-2H3,(H,36,37,39)
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n/an/a>1.25E+5n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAK by HTRF assay


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Protein-tyrosine kinase 2-beta


(Mus musculus)
BDBM50301364
PNG
(CHEMBL570380 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccs4)nc3)c2cc1OC
Show InChI InChI=1S/C32H24N4O5S/c1-39-27-16-23-25(17-28(27)40-2)33-13-12-26(23)41-22-10-11-30(34-18-22)35-31(37)24-15-20(29-9-6-14-42-29)19-36(32(24)38)21-7-4-3-5-8-21/h3-19H,1-2H3,(H,34,35,37)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of mouse Pyk2 in MC3TC3 cells assessed as increase in alkaline phosphatase level


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Protein-tyrosine kinase 2-beta


(Mus musculus)
BDBM50301364
PNG
(CHEMBL570380 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccs4)nc3)c2cc1OC
Show InChI InChI=1S/C32H24N4O5S/c1-39-27-16-23-25(17-28(27)40-2)33-13-12-26(23)41-22-10-11-30(34-18-22)35-31(37)24-15-20(29-9-6-14-42-29)19-36(32(24)38)21-7-4-3-5-8-21/h3-19H,1-2H3,(H,34,35,37)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of mouse Pyk2 in MC3TC3 cells assessed as increase in osteocalcin level


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Protein-tyrosine kinase 2-beta


(Mus musculus)
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of mouse Pyk2 in MC3TC3 cells assessed as increase in osteocalcin level


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Protein-tyrosine kinase 2-beta


(Mus musculus)
BDBM50301364
PNG
(CHEMBL570380 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)c4cc(cn(-c5ccccc5)c4=O)-c4cccs4)nc3)c2cc1OC
Show InChI InChI=1S/C32H24N4O5S/c1-39-27-16-23-25(17-28(27)40-2)33-13-12-26(23)41-22-10-11-30(34-18-22)35-31(37)24-15-20(29-9-6-14-42-29)19-36(32(24)38)21-7-4-3-5-8-21/h3-19H,1-2H3,(H,34,35,37)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of mouse Pyk2 in MC3TC3 cells assessed as increase in calcium level


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Protein-tyrosine kinase 2-beta


(Mus musculus)
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of mouse Pyk2 in MC3TC3 cells assessed as increase in alkaline phosphatase level


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
Protein-tyrosine kinase 2-beta


(Mus musculus)
BDBM50301356
PNG
(CHEMBL585927 | N-(5-(6,7-dimethoxyquinolin-4-yloxy...)
Show SMILES CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1
Show InChI InChI=1S/C29H25N5O5/c1-30-21-12-14-34(18-7-5-4-6-8-18)29(36)27(21)28(35)33-26-10-9-19(17-32-26)39-23-11-13-31-22-16-25(38-3)24(37-2)15-20(22)23/h4-17,30H,1-3H3,(H,32,33,35)
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Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of mouse Pyk2 in MC3TC3 cells assessed as increase in calcium level


Bioorg Med Chem Lett 19: 4924-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.084
BindingDB Entry DOI: 10.7270/Q2N017G2
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%