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PubMed code 21925880

Compile data set for download or QSAR
Found 14 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
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))		BDBM50356930
PNG
(CHEMBL1914475)
Show SMILES CC(=O)Nc1cn2cc(C=C3SC(O)=NC3=O)ccc2n1 |w:9.8,c:13|
Show InChI InChI=1S/C13H10N4O3S/c1-7(18)14-10-6-17-5-8(2-3-11(17)15-10)4-9-12(19)16-13(20)21-9/h2-6H,1H3,(H,14,18)(H,16,19,20)
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n/an/a 25n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha by HTRF assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50189744
PNG
((Z)-5-((5-(4-fluoro-2-hydroxyphenyl)furan-2-yl)met...)
Show SMILES Oc1cc(F)ccc1-c1ccc(\C=C2/SC(=O)NC2=O)o1
Show InChI InChI=1S/C14H8FNO4S/c15-7-1-3-9(10(17)5-7)11-4-2-8(20-11)6-12-13(18)16-14(19)21-12/h1-6,17H,(H,16,18,19)/b12-6-
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n/an/a 30n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma by HTRF assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356930
PNG
(CHEMBL1914475)
Show SMILES CC(=O)Nc1cn2cc(C=C3SC(O)=NC3=O)ccc2n1 |w:9.8,c:13|
Show InChI InChI=1S/C13H10N4O3S/c1-7(18)14-10-6-17-5-8(2-3-11(17)15-10)4-9-12(19)16-13(20)21-9/h2-6H,1H3,(H,14,18)(H,16,19,20)
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n/an/a 34n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma by HTRF assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356940
PNG
(CHEMBL1916047)
Show SMILES OC1=NC(=O)C(S1)=Cc1ccc2nccn2c1 |w:7.8,t:1|
Show InChI InChI=1S/C11H7N3O2S/c15-10-8(17-11(16)13-10)5-7-1-2-9-12-3-4-14(9)6-7/h1-6H,(H,13,15,16)
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n/an/a 230n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma by HTRF assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356930
PNG
(CHEMBL1914475)
Show SMILES CC(=O)Nc1cn2cc(C=C3SC(O)=NC3=O)ccc2n1 |w:9.8,c:13|
Show InChI InChI=1S/C13H10N4O3S/c1-7(18)14-10-6-17-5-8(2-3-11(17)15-10)4-9-12(19)16-13(20)21-9/h2-6H,1H3,(H,14,18)(H,16,19,20)
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n/an/a 760n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma in human neutrophils assessed as inhibition of fMLP-stimulated superoxide production

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356939
PNG
(CHEMBL1916046)
Show SMILES CC(=O)Nc1cc2nc(C)cc(C)n2n1
Show InChI InChI=1S/C10H12N4O/c1-6-4-7(2)14-10(11-6)5-9(13-14)12-8(3)15/h4-5H,1-3H3,(H,12,13,15)
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n/an/a 1.90E+4n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma by HTRF assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356937
PNG
(CHEMBL1728139)
Show SMILES Nc1nnc2cc(Cl)ccc2n1
Show InChI InChI=1S/C7H5ClN4/c8-4-1-2-5-6(3-4)11-12-7(9)10-5/h1-3H,(H2,9,10,12)
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n/an/a 5.30E+4n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma assessed as depletion of ATP by kinase-glo luciferase assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356931
PNG
(CHEMBL1916042)
Show SMILES Nc1cn2cc(Br)ccc2n1
Show InChI InChI=1S/C7H6BrN3/c8-5-1-2-7-10-6(9)4-11(7)3-5/h1-4H,9H2
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n/an/a 1.56E+5n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma assessed as depletion of ATP by kinase-glo luciferase assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356932
PNG
(CHEMBL1889525 | cid_40237)
Show SMILES Nc1nc2ccc(Cl)cc2o1
Show InChI InChI=1S/C7H5ClN2O/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10)
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n/an/a 3.80E+5n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma assessed as depletion of ATP by kinase-glo luciferase assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356935
PNG
(CHEMBL1916044)
Show SMILES CC(C)c1nn2cccnc2c1C#N
Show InChI InChI=1S/C10H10N4/c1-7(2)9-8(6-11)10-12-4-3-5-14(10)13-9/h3-5,7H,1-2H3
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n/an/a 3.95E+5n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma assessed as depletion of ATP by kinase-glo luciferase assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356936
PNG
(CHEMBL1916045)
Show SMILES Cc1nn2cccnc2c1C#N
Show InChI InChI=1S/C8H6N4/c1-6-7(5-9)8-10-3-2-4-12(8)11-6/h2-4H,1H3
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n/an/a 7.73E+5n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma assessed as depletion of ATP by kinase-glo luciferase assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356938
PNG
(CHEMBL1916048)
Show SMILES Cc1cc(C)n2nc(N)cc2n1
Show InChI InChI=1S/C8H10N4/c1-5-3-6(2)12-8(10-5)4-7(9)11-12/h3-4H,1-2H3,(H2,9,11)
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n/an/a 9.15E+5n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma assessed as depletion of ATP by kinase-glo luciferase assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356933
PNG
(CHEMBL1887078)
Show SMILES Cc1cc(C)n2nc(N)nc2n1
Show InChI InChI=1S/C7H9N5/c1-4-3-5(2)12-7(9-4)10-6(8)11-12/h3H,1-2H3,(H2,8,11)
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n/an/a>1.60E+6n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma assessed as depletion of ATP by kinase-glo luciferase assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))		BDBM50356934
PNG
(CHEMBL1916043)
Show SMILES Cc1cc(Cl)n2ncnc2n1
Show InChI InChI=1S/C6H5ClN4/c1-4-2-5(7)11-6(10-4)8-3-9-11/h2-3H,1H3
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n/an/a>1.67E+6n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PI3Kgamma assessed as depletion of ATP by kinase-glo luciferase assay

Bioorg Med Chem Lett 21: 6586-90 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.117
BindingDB Entry DOI: 10.7270/Q2GF0TW1
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%