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PubMed code 24681986

Compile data set for download or QSAR
Found 42 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
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50335638
PNG
(5-(3-Chlorophenylamino)benzo[c][2,6]naphthyridine-...)
Show SMILES OC(=O)c1ccc2c(c1)nc(Nc1cccc(Cl)c1)c1ccncc21
Show InChI InChI=1S/C19H12ClN3O2/c20-12-2-1-3-13(9-12)22-18-15-6-7-21-10-16(15)14-5-4-11(19(24)25)8-17(14)23-18/h1-10H,(H,22,23)(H,24,25)
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n/an/a 100n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM7533
PNG
((2R)-2-[[6-(benzylamino)-9-isopropyl-purin-2-yl]am...)
Show SMILES CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C19H26N6O/c1-4-15(11-26)22-19-23-17(20-10-14-8-6-5-7-9-14)16-18(24-19)25(12-21-16)13(2)3/h5-9,12-13,15,26H,4,10-11H2,1-3H3,(H2,20,22,23,24)/t15-/m1/s1
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n/an/a 100n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM13530
PNG
(4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[...)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
Show InChI InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)
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n/an/a 300n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50335638
PNG
(5-(3-Chlorophenylamino)benzo[c][2,6]naphthyridine-...)
Show SMILES OC(=O)c1ccc2c(c1)nc(Nc1cccc(Cl)c1)c1ccncc21
Show InChI InChI=1S/C19H12ClN3O2/c20-12-2-1-3-13(9-12)22-18-15-6-7-21-10-16(15)14-5-4-11(19(24)25)8-17(14)23-18/h1-10H,(H,22,23)(H,24,25)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004348
PNG
(CHEMBL3237850)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCNCC3)nc12
Show InChI InChI=1S/C16H20N8O2S/c1-11-14-15(23(2)22-11)20-21-16(19-14)18-12-3-5-13(6-4-12)27(25,26)24-9-7-17-8-10-24/h3-6,17H,7-10H2,1-2H3,(H,18,19,21)
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n/an/a 5.80E+3n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004350
PNG
(CHEMBL3237852)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCCNCC3)nc12
Show InChI InChI=1S/C17H22N8O2S/c1-12-15-16(24(2)23-12)21-22-17(20-15)19-13-4-6-14(7-5-13)28(26,27)25-10-3-8-18-9-11-25/h4-7,18H,3,8-11H2,1-2H3,(H,19,20,22)
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n/an/a 5.90E+3n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004340
PNG
(CHEMBL3237854)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN)nc12
Show InChI InChI=1S/C14H18N8O2S/c1-9-12-13(22(2)21-9)19-20-14(18-12)17-10-3-5-11(6-4-10)25(23,24)16-8-7-15/h3-6,16H,7-8,15H2,1-2H3,(H,17,18,20)
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n/an/a 1.50E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004344
PNG
(CHEMBL3237857)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCOCC3)nc12
Show InChI InChI=1S/C18H24N8O3S/c1-13-16-17(25(2)24-13)22-23-18(21-16)20-14-3-5-15(6-4-14)30(27,28)19-7-8-26-9-11-29-12-10-26/h3-6,19H,7-12H2,1-2H3,(H,20,21,23)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004336
PNG
(CHEMBL3237853)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCCCC3)nc12
Show InChI InChI=1S/C17H21N7O2S/c1-12-15-16(23(2)22-12)20-21-17(19-15)18-13-6-8-14(9-7-13)27(25,26)24-10-4-3-5-11-24/h6-9H,3-5,10-11H2,1-2H3,(H,18,19,21)
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n/an/a>2.50E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004347
PNG
(CHEMBL3237849)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCOCC3)nc12
Show InChI InChI=1S/C16H19N7O3S/c1-11-14-15(22(2)21-11)19-20-16(18-14)17-12-3-5-13(6-4-12)27(24,25)23-7-9-26-10-8-23/h3-6H,7-10H2,1-2H3,(H,17,18,20)
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n/an/a>2.50E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004348
PNG
(CHEMBL3237850)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCNCC3)nc12
Show InChI InChI=1S/C16H20N8O2S/c1-11-14-15(23(2)22-11)20-21-16(19-14)18-12-3-5-13(6-4-12)27(25,26)24-9-7-17-8-10-24/h3-6,17H,7-10H2,1-2H3,(H,18,19,21)
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n/an/a>2.50E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004336
PNG
(CHEMBL3237853)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCCCC3)nc12
Show InChI InChI=1S/C17H21N7O2S/c1-12-15-16(23(2)22-12)20-21-17(19-15)18-13-6-8-14(9-7-13)27(25,26)24-10-4-3-5-11-24/h6-9H,3-5,10-11H2,1-2H3,(H,18,19,21)
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n/an/a>2.50E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004347
PNG
(CHEMBL3237849)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCOCC3)nc12
Show InChI InChI=1S/C16H19N7O3S/c1-11-14-15(22(2)21-11)19-20-16(18-14)17-12-3-5-13(6-4-12)27(24,25)23-7-9-26-10-8-23/h3-6H,7-10H2,1-2H3,(H,17,18,20)
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n/an/a>2.50E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004348
PNG
(CHEMBL3237850)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCNCC3)nc12
Show InChI InChI=1S/C16H20N8O2S/c1-11-14-15(23(2)22-11)20-21-16(19-14)18-12-3-5-13(6-4-12)27(25,26)24-9-7-17-8-10-24/h3-6,17H,7-10H2,1-2H3,(H,18,19,21)
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n/an/a>2.50E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004336
PNG
(CHEMBL3237853)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCCCC3)nc12
Show InChI InChI=1S/C17H21N7O2S/c1-12-15-16(23(2)22-12)20-21-17(19-15)18-13-6-8-14(9-7-13)27(25,26)24-10-4-3-5-11-24/h6-9H,3-5,10-11H2,1-2H3,(H,18,19,21)
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n/an/a>2.50E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004347
PNG
(CHEMBL3237849)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCOCC3)nc12
Show InChI InChI=1S/C16H19N7O3S/c1-11-14-15(22(2)21-11)19-20-16(18-14)17-12-3-5-13(6-4-12)27(24,25)23-7-9-26-10-8-23/h3-6H,7-10H2,1-2H3,(H,17,18,20)
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n/an/a>2.50E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004342
PNG
(CHEMBL3237855)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(N)(=O)=O)nc12
Show InChI InChI=1S/C12H13N7O2S/c1-7-10-11(19(2)18-7)16-17-12(15-10)14-8-3-5-9(6-4-8)22(13,20)21/h3-6H,1-2H3,(H2,13,20,21)(H,14,15,17)
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n/an/a 3.30E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004345
PNG
(CHEMBL3237858)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCC(O)CO)nc12
Show InChI InChI=1S/C15H19N7O4S/c1-9-13-14(22(2)21-9)19-20-15(18-13)17-10-3-5-12(6-4-10)27(25,26)16-7-11(24)8-23/h3-6,11,16,23-24H,7-8H2,1-2H3,(H,17,18,20)
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n/an/a 3.40E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004340
PNG
(CHEMBL3237854)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN)nc12
Show InChI InChI=1S/C14H18N8O2S/c1-9-12-13(22(2)21-9)19-20-14(18-12)17-10-3-5-11(6-4-10)25(23,24)16-8-7-15/h3-6,16H,7-8,15H2,1-2H3,(H,17,18,20)
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n/an/a 3.49E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004349
PNG
(CHEMBL3237851)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCCO)nc12
Show InChI InChI=1S/C14H17N7O3S/c1-9-12-13(21(2)20-9)18-19-14(17-12)16-10-3-5-11(6-4-10)25(23,24)15-7-8-22/h3-6,15,22H,7-8H2,1-2H3,(H,16,17,19)
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n/an/a 3.90E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004351
PNG
(CHEMBL3233061)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCCC3)nc12
Show InChI InChI=1S/C16H19N7O2S/c1-11-14-15(22(2)21-11)19-20-16(18-14)17-12-5-7-13(8-6-12)26(24,25)23-9-3-4-10-23/h5-8H,3-4,9-10H2,1-2H3,(H,17,18,20)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004342
PNG
(CHEMBL3237855)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(N)(=O)=O)nc12
Show InChI InChI=1S/C12H13N7O2S/c1-7-10-11(19(2)18-7)16-17-12(15-10)14-8-3-5-9(6-4-8)22(13,20)21/h3-6H,1-2H3,(H2,13,20,21)(H,14,15,17)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004350
PNG
(CHEMBL3237852)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCCNCC3)nc12
Show InChI InChI=1S/C17H22N8O2S/c1-12-15-16(24(2)23-12)21-22-17(20-15)19-13-4-6-14(7-5-13)28(26,27)25-10-3-8-18-9-11-25/h4-7,18H,3,8-11H2,1-2H3,(H,19,20,22)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004346
PNG
(CHEMBL3237848)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1ccc(Nc2nnc3n(C)nc(C)c3n2)cc1
Show InChI InChI=1S/C17H22N8O2S/c1-12-15-16(24(3)22-12)20-21-17(19-15)18-13-4-6-14(7-5-13)28(26,27)25-10-8-23(2)9-11-25/h4-7H,8-11H2,1-3H3,(H,18,19,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004350
PNG
(CHEMBL3237852)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCCNCC3)nc12
Show InChI InChI=1S/C17H22N8O2S/c1-12-15-16(24(2)23-12)21-22-17(20-15)19-13-4-6-14(7-5-13)28(26,27)25-10-3-8-18-9-11-25/h4-7,18H,3,8-11H2,1-2H3,(H,19,20,22)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004343
PNG
(CHEMBL3237856)
Show SMILES CC(C)C(CO)NS(=O)(=O)c1ccc(Nc2nnc3n(C)nc(C)c3n2)cc1
Show InChI InChI=1S/C17H23N7O3S/c1-10(2)14(9-25)23-28(26,27)13-7-5-12(6-8-13)18-17-19-15-11(3)22-24(4)16(15)20-21-17/h5-8,10,14,23,25H,9H2,1-4H3,(H,18,19,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004343
PNG
(CHEMBL3237856)
Show SMILES CC(C)C(CO)NS(=O)(=O)c1ccc(Nc2nnc3n(C)nc(C)c3n2)cc1
Show InChI InChI=1S/C17H23N7O3S/c1-10(2)14(9-25)23-28(26,27)13-7-5-12(6-8-13)18-17-19-15-11(3)22-24(4)16(15)20-21-17/h5-8,10,14,23,25H,9H2,1-4H3,(H,18,19,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004344
PNG
(CHEMBL3237857)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCOCC3)nc12
Show InChI InChI=1S/C18H24N8O3S/c1-13-16-17(25(2)24-13)22-23-18(21-16)20-14-3-5-15(6-4-14)30(27,28)19-7-8-26-9-11-29-12-10-26/h3-6,19H,7-12H2,1-2H3,(H,20,21,23)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004349
PNG
(CHEMBL3237851)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCCO)nc12
Show InChI InChI=1S/C14H17N7O3S/c1-9-12-13(21(2)20-9)18-19-14(17-12)16-10-3-5-11(6-4-10)25(23,24)15-7-8-22/h3-6,15,22H,7-8H2,1-2H3,(H,16,17,19)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004344
PNG
(CHEMBL3237857)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCOCC3)nc12
Show InChI InChI=1S/C18H24N8O3S/c1-13-16-17(25(2)24-13)22-23-18(21-16)20-14-3-5-15(6-4-14)30(27,28)19-7-8-26-9-11-29-12-10-26/h3-6,19H,7-12H2,1-2H3,(H,20,21,23)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004351
PNG
(CHEMBL3233061)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCCC3)nc12
Show InChI InChI=1S/C16H19N7O2S/c1-11-14-15(22(2)21-11)19-20-16(18-14)17-12-5-7-13(8-6-12)26(24,25)23-9-3-4-10-23/h5-8H,3-4,9-10H2,1-2H3,(H,17,18,20)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004349
PNG
(CHEMBL3237851)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCCO)nc12
Show InChI InChI=1S/C14H17N7O3S/c1-9-12-13(21(2)20-9)18-19-14(17-12)16-10-3-5-11(6-4-10)25(23,24)15-7-8-22/h3-6,15,22H,7-8H2,1-2H3,(H,16,17,19)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004351
PNG
(CHEMBL3233061)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)N3CCCC3)nc12
Show InChI InChI=1S/C16H19N7O2S/c1-11-14-15(22(2)21-11)19-20-16(18-14)17-12-5-7-13(8-6-12)26(24,25)23-9-3-4-10-23/h5-8H,3-4,9-10H2,1-2H3,(H,17,18,20)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004345
PNG
(CHEMBL3237858)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCC(O)CO)nc12
Show InChI InChI=1S/C15H19N7O4S/c1-9-13-14(22(2)21-9)19-20-15(18-13)17-10-3-5-12(6-4-10)27(25,26)16-7-11(24)8-23/h3-6,11,16,23-24H,7-8H2,1-2H3,(H,17,18,20)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004343
PNG
(CHEMBL3237856)
Show SMILES CC(C)C(CO)NS(=O)(=O)c1ccc(Nc2nnc3n(C)nc(C)c3n2)cc1
Show InChI InChI=1S/C17H23N7O3S/c1-10(2)14(9-25)23-28(26,27)13-7-5-12(6-8-13)18-17-19-15-11(3)22-24(4)16(15)20-21-17/h5-8,10,14,23,25H,9H2,1-4H3,(H,18,19,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004346
PNG
(CHEMBL3237848)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1ccc(Nc2nnc3n(C)nc(C)c3n2)cc1
Show InChI InChI=1S/C17H22N8O2S/c1-12-15-16(24(3)22-12)20-21-17(19-15)18-13-4-6-14(7-5-13)28(26,27)25-10-8-23(2)9-11-25/h4-7H,8-11H2,1-3H3,(H,18,19,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004345
PNG
(CHEMBL3237858)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCC(O)CO)nc12
Show InChI InChI=1S/C15H19N7O4S/c1-9-13-14(22(2)21-9)19-20-15(18-13)17-10-3-5-12(6-4-10)27(25,26)16-7-11(24)8-23/h3-6,11,16,23-24H,7-8H2,1-2H3,(H,17,18,20)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))		BDBM50004340
PNG
(CHEMBL3237854)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN)nc12
Show InChI InChI=1S/C14H18N8O2S/c1-9-12-13(22(2)21-9)19-20-14(18-12)17-10-3-5-11(6-4-10)25(23,24)16-8-7-15/h3-6,16H,7-8,15H2,1-2H3,(H,17,18,20)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CK2alpha1 (unknown origin) using casein as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM50004346
PNG
(CHEMBL3237848)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1ccc(Nc2nnc3n(C)nc(C)c3n2)cc1
Show InChI InChI=1S/C17H22N8O2S/c1-12-15-16(24(3)22-12)20-21-17(19-15)18-13-4-6-14(7-5-13)28(26,27)25-10-8-23(2)9-11-25/h4-7H,8-11H2,1-3H3,(H,18,19,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM50004342
PNG
(CHEMBL3237855)
Show SMILES Cc1nn(C)c2nnc(Nc3ccc(cc3)S(N)(=O)=O)nc12
Show InChI InChI=1S/C12H13N7O2S/c1-7-10-11(19(2)18-7)16-17-12(15-10)14-8-3-5-9(6-4-8)22(13,20)21/h3-6H,1-2H3,(H2,13,20,21)(H,14,15,17)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))		BDBM7533
PNG
((2R)-2-[[6-(benzylamino)-9-isopropyl-purin-2-yl]am...)
Show SMILES CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C19H26N6O/c1-4-15(11-26)22-19-23-17(20-10-14-8-6-5-7-9-14)16-18(24-19)25(12-21-16)13(2)3/h5-9,12-13,15,26H,4,10-11H2,1-3H3,(H2,20,22,23,24)/t15-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of recombinant Abl kinase (unknown origin) expressed in Sf9 cells using GGEAIYAAPFKK as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1


(Homo sapiens (Human))		BDBM13530
PNG
(4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[...)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
Show InChI InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Siedlce University of Natural Sciences and Humanities

Curated by ChEMBL


Assay Description
Inhibition of CDK2/cyclin E (unknown origin) expressed in Sf9 cells using histone H1 as substrate in presence of [gamma33P]ATP

Eur J Med Chem 78: 217-24 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.054
BindingDB Entry DOI: 10.7270/Q29G5PBW
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%