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Patent code US9775844

Compile Data Set for Download or QSAR

Found 440 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 beta isoform


(Homo sapiens (Human))
BDBM342554
PNG
(US10329299, Compound 105 | US9775844, Compound 105)
Show SMILES CC[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C31H26N8O2/c1-3-24(35-30(40)27-28(32)36-38-16-8-15-33-29(27)38)25-17-22-10-7-9-21(14-13-20-18-34-37(2)19-20)26(22)31(41)39(25)23-11-5-4-6-12-23/h4-12,15-19,24H,3H2,1-2H3,(H2,32,36)(H,35,40)/t24-/s2
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n/an/a 2.00E+3n/an/an/an/an/an/a



Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342554
PNG
(US10329299, Compound 105 | US9775844, Compound 105)
Show SMILES CC[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C31H26N8O2/c1-3-24(35-30(40)27-28(32)36-38-16-8-15-33-29(27)38)25-17-22-10-7-9-21(14-13-20-18-34-37(2)19-20)26(22)31(41)39(25)23-11-5-4-6-12-23/h4-12,15-19,24H,3H2,1-2H3,(H2,32,36)(H,35,40)/t24-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342555
PNG
(US10329299, Compound 106 | US9775844, Compound 106)
Show SMILES C[C@H](NC(=O)c1c(N)nn2ccc(C)nc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C31H26N8O2/c1-19-14-15-38-29(34-19)27(28(32)36-38)30(40)35-20(2)25-16-23-9-7-8-22(13-12-21-17-33-37(3)18-21)26(23)31(41)39(25)24-10-5-4-6-11-24/h4-11,14-18,20H,1-3H3,(H2,32,36)(H,35,40)/t20-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342558
PNG
(US10329299, Compound 109 | US9775844, Compound 109)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(N)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C24H21N7O2/c1-14(28-23(32)20-21(26)29-30-12-6-11-27-22(20)30)18-13-15-7-5-10-17(25)19(15)24(33)31(18)16-8-3-2-4-9-16/h2-14H,25H2,1H3,(H2,26,29)(H,28,32)/t14-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342558
PNG
(US10329299, Compound 109 | US9775844, Compound 109)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(N)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C24H21N7O2/c1-14(28-23(32)20-21(26)29-30-12-6-11-27-22(20)30)18-13-15-7-5-10-17(25)19(15)24(33)31(18)16-8-3-2-4-9-16/h2-14H,25H2,1H3,(H2,26,29)(H,28,32)/t14-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50192880
PNG
(CHEMBL3984425 | US10329299, Compound 21 | US977584...)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H24N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-22-9-6-8-21(13-12-20-17-33-36(2)18-20)25(22)30(40)38(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,31,35)(H,34,39)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50192880
PNG
(CHEMBL3984425 | US10329299, Compound 21 | US977584...)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H24N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-22-9-6-8-21(13-12-20-17-33-36(2)18-20)25(22)30(40)38(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,31,35)(H,34,39)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50192880
PNG
(CHEMBL3984425 | US10329299, Compound 21 | US977584...)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H24N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-22-9-6-8-21(13-12-20-17-33-36(2)18-20)25(22)30(40)38(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,31,35)(H,34,39)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50192892
PNG
(CHEMBL3966879 | US10329299, Compound 5 | US9775844...)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccccc3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C32H24N6O2/c1-21(35-31(39)28-29(33)36-37-19-9-18-34-30(28)37)26-20-24-13-8-12-23(17-16-22-10-4-2-5-11-22)27(24)32(40)38(26)25-14-6-3-7-15-25/h2-15,18-21H,1H3,(H2,33,36)(H,35,39)/t21-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM340019
PNG
(US10329299, Compound 11 | US9775844, Compound 11)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC(C)(C)O)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C29H26N6O3/c1-18(32-27(36)24-25(30)33-34-16-8-15-31-26(24)34)22-17-20-10-7-9-19(13-14-29(2,3)38)23(20)28(37)35(22)21-11-5-4-6-12-21/h4-12,15-18,38H,1-3H3,(H2,30,33)(H,32,36)/t18-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM340019
PNG
(US10329299, Compound 11 | US9775844, Compound 11)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC(C)(C)O)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C29H26N6O3/c1-18(32-27(36)24-25(30)33-34-16-8-15-31-26(24)34)22-17-20-10-7-9-19(13-14-29(2,3)38)23(20)28(37)35(22)21-11-5-4-6-12-21/h4-12,15-18,38H,1-3H3,(H2,30,33)(H,32,36)/t18-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM340022
PNG
(US10329299, Compound 14 | US9775844, Compound 14)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CCN3CCCC3=O)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C31H27N7O3/c1-20(34-30(40)27-28(32)35-37-18-8-15-33-29(27)37)24-19-22-10-5-9-21(11-6-16-36-17-7-14-25(36)39)26(22)31(41)38(24)23-12-3-2-4-13-23/h2-5,8-10,12-13,15,18-20H,7,14,16-17H2,1H3,(H2,32,35)(H,34,40)/t20-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM340023
PNG
(US10329299, Compound 15 | US9775844, Compound 15)
Show SMILES C[C@@H](O)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12
Show InChI InChI=1/C28H24N6O3/c1-17(35)12-13-19-8-6-9-20-16-22(34(28(37)23(19)20)21-10-4-3-5-11-21)18(2)31-27(36)24-25(29)32-33-15-7-14-30-26(24)33/h3-11,14-18,35H,1-2H3,(H2,29,32)(H,31,36)/t17-,18+/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM340026
PNG
(US10329299, Compound 18 | US9775844, Compound 18)
Show SMILES COc1ncc(cn1)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12
Show InChI InChI=1/C31H24N8O3/c1-19(36-29(40)26-27(32)37-38-15-7-14-33-28(26)38)24-16-22-9-6-8-21(13-12-20-17-34-31(42-2)35-18-20)25(22)30(41)39(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,32,37)(H,36,40)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342453
PNG
(US10329299, Compound 24 | US9775844, Compound 24)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CC3)c2c(=O)n1C1CC1
Show InChI InChI=1/C26H24N6O2/c1-15(29-25(33)22-23(27)30-31-13-3-12-28-24(22)31)20-14-18-5-2-4-17(9-8-16-6-7-16)21(18)26(34)32(20)19-10-11-19/h2-5,12-16,19H,6-7,10-11H2,1H3,(H2,27,30)(H,29,33)/t15-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342467
PNG
(US10329299, Compound 36 | US9775844, Compound 36)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC=O)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C27H20N6O3/c1-17(30-26(35)23-24(28)31-32-14-7-13-29-25(23)32)21-16-19-9-5-8-18(10-6-15-34)22(19)27(36)33(21)20-11-3-2-4-12-20/h2-5,7-9,11-17H,1H3,(H2,28,31)(H,30,35)/t17-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342471
PNG
(US10329299, Compound 63 | US9775844, Compound 40)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3csc(C)n3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H23N7O2S/c1-18(33-29(38)26-27(31)35-36-15-7-14-32-28(26)36)24-16-21-9-6-8-20(12-13-22-17-40-19(2)34-22)25(21)30(39)37(24)23-10-4-3-5-11-23/h3-11,14-18H,1-2H3,(H2,31,35)(H,33,38)/t18-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342475
PNG
(US9775844, Compound 43)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnc[nH]3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C29H22N8O2/c1-18(34-28(38)25-26(30)35-36-14-6-13-32-27(25)36)23-15-20-8-5-7-19(11-12-21-16-31-17-33-21)24(20)29(39)37(23)22-9-3-2-4-10-22/h2-10,13-18H,1H3,(H2,30,35)(H,31,33)(H,34,38)/t18-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342477
PNG
(US10329299, Compound 45 | US9775844, Compound 45)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#C)c2c(=O)n1-c1ccc(F)c(F)c1
Show InChI InChI=1/C25H17F2N7O2/c1-3-14-6-4-7-18-19(14)25(36)34(15-8-9-16(26)17(27)12-15)22(31-18)13(2)30-24(35)20-21(28)32-33-11-5-10-29-23(20)33/h1,4-13H,2H3,(H2,28,32)(H,30,35)/t13-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342479
PNG
(US10329299, Compound 47 | US9775844, Compound 47)
Show SMILES C[C@H](NC(=O)c1nccnc1N)c1nc2cccc(C#C)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C23H18N6O2/c1-3-15-8-7-11-17-18(15)23(31)29(16-9-5-4-6-10-16)21(28-17)14(2)27-22(30)19-20(24)26-13-12-25-19/h1,4-14H,2H3,(H2,24,26)(H,27,30)/t14-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342479
PNG
(US10329299, Compound 47 | US9775844, Compound 47)
Show SMILES C[C@H](NC(=O)c1nccnc1N)c1nc2cccc(C#C)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C23H18N6O2/c1-3-15-8-7-11-17-18(15)23(31)29(16-9-5-4-6-10-16)21(28-17)14(2)27-22(30)19-20(24)26-13-12-25-19/h1,4-14H,2H3,(H2,24,26)(H,27,30)/t14-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342489
PNG
(US10329299, Compound 56 | US9775844, Compound 56)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CCN3CCN(C)CC3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C32H32N8O2/c1-22(35-31(41)28-29(33)36-39-16-8-14-34-30(28)39)26-21-24-10-6-9-23(11-7-15-38-19-17-37(2)18-20-38)27(24)32(42)40(26)25-12-4-3-5-13-25/h3-6,8-10,12-14,16,21-22H,15,17-20H2,1-2H3,(H2,33,36)(H,35,41)/t22-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342490
PNG
(US10329299, Compound 57 | US9775844, Compound 57)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CCN(C)C)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C29H27N7O2/c1-19(32-28(37)25-26(30)33-35-17-9-15-31-27(25)35)23-18-21-11-7-10-20(12-8-16-34(2)3)24(21)29(38)36(23)22-13-5-4-6-14-22/h4-7,9-11,13-15,17-19H,16H2,1-3H3,(H2,30,33)(H,32,37)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342494
PNG
(US10329299, Compound 60 | US9775844, Compound 60)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3nc(C)cs3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H23N7O2S/c1-18-17-40-24(33-18)13-12-20-8-6-9-21-16-23(37(30(39)25(20)21)22-10-4-3-5-11-22)19(2)34-29(38)26-27(31)35-36-15-7-14-32-28(26)36/h3-11,14-17,19H,1-2H3,(H2,31,35)(H,34,38)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342496
PNG
(US10329299, Compound 62 | US9775844, Compound 62)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3(O)CN4CCC3CC4)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C33H31N7O3/c1-21(36-31(41)28-29(34)37-39-16-6-15-35-30(28)39)26-19-23-8-5-7-22(11-14-33(43)20-38-17-12-24(33)13-18-38)27(23)32(42)40(26)25-9-3-2-4-10-25/h2-10,15-16,19,21,24,43H,12-13,17-18,20H2,1H3,(H2,34,37)(H,36,41)/t21-,33?/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342500
PNG
(US10329299, Compound 65 | US9775844, Compound 65)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCCCC3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C32H30N6O2/c1-21(35-31(39)28-29(33)36-37-19-9-18-34-30(28)37)26-20-24-13-8-12-23(17-16-22-10-4-2-5-11-22)27(24)32(40)38(26)25-14-6-3-7-15-25/h3,6-9,12-15,18-22H,2,4-5,10-11H2,1H3,(H2,33,36)(H,35,39)/t21-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342501
PNG
(US10329299, Compound 66 | US9775844, Compound 66)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cocn3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C29H21N7O3/c1-18(33-28(37)25-26(30)34-35-14-6-13-31-27(25)35)23-15-20-8-5-7-19(11-12-21-16-39-17-32-21)24(20)29(38)36(23)22-9-3-2-4-10-22/h2-10,13-18H,1H3,(H2,30,34)(H,33,37)/t18-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342516
PNG
(US10329299, Compound 67 | US9775844, Compound 67)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cccnc3C)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C32H25N7O2/c1-20-22(11-7-16-34-20)14-15-23-9-6-10-24-19-26(39(32(41)27(23)24)25-12-4-3-5-13-25)21(2)36-31(40)28-29(33)37-38-18-8-17-35-30(28)38/h3-13,16-19,21H,1-2H3,(H2,33,37)(H,36,40)/t21-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342517
PNG
(US10329299, Compound 68 | US9775844, Compound 68)
Show SMILES C[C@H](NC(=O)c1ncc(C)nc1N)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C29H25N7O2/c1-18-15-31-26(27(30)33-18)28(37)34-19(2)24-14-22-9-7-8-21(13-12-20-16-32-35(3)17-20)25(22)29(38)36(24)23-10-5-4-6-11-23/h4-11,14-17,19H,1-3H3,(H2,30,33)(H,34,37)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50192886
PNG
(CHEMBL3946030 | US10329299, Compound 70 | US977584...)
Show SMILES C\C=C\c1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12
Show InChI InChI=1/C27H24N6O2/c1-3-9-18-10-7-11-19-16-21(33(27(35)22(18)19)20-12-5-4-6-13-20)17(2)30-26(34)23-24(28)31-32-15-8-14-29-25(23)32/h3-17H,1-2H3,(H2,28,31)(H,30,34)/b9-3+/t17-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342521
PNG
(US10329299, Compound 72 | US9775844, Compound 72)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCNCC3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C31H29N7O2/c1-20(35-30(39)27-28(32)36-37-18-6-15-34-29(27)37)25-19-23-8-5-7-22(12-11-21-13-16-33-17-14-21)26(23)31(40)38(25)24-9-3-2-4-10-24/h2-10,15,18-21,33H,13-14,16-17H2,1H3,(H2,32,36)(H,35,39)/t20-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342527
PNG
(US10329299, Compound 78 | US9775844, Compound 78)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ncsc3C)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H23N7O2S/c1-18(34-29(38)26-27(31)35-36-15-7-14-32-28(26)36)24-16-21-9-6-8-20(12-13-23-19(2)40-17-33-23)25(21)30(39)37(24)22-10-4-3-5-11-22/h3-11,14-18H,1-2H3,(H2,31,35)(H,34,38)/t18-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342530
PNG
(US10329299, Compound 81 | US9775844, Compound 81)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cn(C)cn3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H24N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-21-9-6-8-20(12-13-22-17-36(2)18-33-22)25(21)30(40)38(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,31,35)(H,34,39)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342530
PNG
(US10329299, Compound 81 | US9775844, Compound 81)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cn(C)cn3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H24N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-21-9-6-8-20(12-13-22-17-36(2)18-33-22)25(21)30(40)38(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,31,35)(H,34,39)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342536
PNG
(US10329299, Compound 87 | US9775844, Compound 87)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(\C=C\c3ccccc3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C32H26N6O2/c1-21(35-31(39)28-29(33)36-37-19-9-18-34-30(28)37)26-20-24-13-8-12-23(17-16-22-10-4-2-5-11-22)27(24)32(40)38(26)25-14-6-3-7-15-25/h2-21H,1H3,(H2,33,36)(H,35,39)/b17-16+/t21-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342536
PNG
(US10329299, Compound 87 | US9775844, Compound 87)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(\C=C\c3ccccc3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C32H26N6O2/c1-21(35-31(39)28-29(33)36-37-19-9-18-34-30(28)37)26-20-24-13-8-12-23(17-16-22-10-4-2-5-11-22)27(24)32(40)38(26)25-14-6-3-7-15-25/h2-21H,1H3,(H2,33,36)(H,35,39)/b17-16+/t21-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342540
PNG
(US10329299, Compound 91 | US9775844, Compound 91)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(CC(=O)c3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H26N8O3/c1-18(34-29(40)26-27(31)35-37-13-7-12-32-28(26)37)23-14-19-8-6-9-20(15-24(39)21-16-33-36(2)17-21)25(19)30(41)38(23)22-10-4-3-5-11-22/h3-14,16-18H,15H2,1-2H3,(H2,31,35)(H,34,40)/t18-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342541
PNG
(US10329299, Compound 92 | US9775844, Compound 92)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(CC(=O)c3cn[nH]c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C29H24N8O3/c1-17(34-28(39)25-26(30)35-36-12-6-11-31-27(25)36)22-13-18-7-5-8-19(14-23(38)20-15-32-33-16-20)24(18)29(40)37(22)21-9-3-2-4-10-21/h2-13,15-17H,14H2,1H3,(H2,30,35)(H,32,33)(H,34,39)/t17-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342546
PNG
(US10329299, Compound 97 | US9775844, Compound 97)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccc(F)c(F)c1
Show InChI InChI=1/C30H22F2N8O2/c1-17(36-29(41)26-27(33)37-39-12-4-11-34-28(26)39)24-13-20-6-3-5-19(8-7-18-15-35-38(2)16-18)25(20)30(42)40(24)21-9-10-22(31)23(32)14-21/h3-6,9-17H,1-2H3,(H2,33,37)(H,36,41)/t17-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM342546
PNG
(US10329299, Compound 97 | US9775844, Compound 97)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccc(F)c(F)c1
Show InChI InChI=1/C30H22F2N8O2/c1-17(36-29(41)26-27(33)37-39-12-4-11-34-28(26)39)24-13-20-6-3-5-19(8-7-18-15-35-38(2)16-18)25(20)30(42)40(24)21-9-10-22(31)23(32)14-21/h3-6,9-17H,1-2H3,(H2,33,37)(H,36,41)/t17-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342547
PNG
(US10329299, Compound 98 | US9775844, Compound 98)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccc(C)cc1
Show InChI InChI=1/C31H26N8O2/c1-19-8-12-24(13-9-19)39-25(20(2)35-30(40)27-28(32)36-38-15-5-14-33-29(27)38)16-23-7-4-6-22(26(23)31(39)41)11-10-21-17-34-37(3)18-21/h4-9,12-18,20H,1-3H3,(H2,32,36)(H,35,40)/t20-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342548
PNG
(US10329299, Compound 99 | US9775844, Compound 99)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1C1CCCCC1
Show InChI InChI=1/C30H30N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-22-9-6-8-21(13-12-20-17-33-36(2)18-20)25(22)30(40)38(24)23-10-4-3-5-11-23/h6-9,14-19,23H,3-5,10-11H2,1-2H3,(H2,31,35)(H,34,39)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342549
PNG
(US10329299, Compound 100 | US9775844, Compound 100)
Show SMILES CNS(=O)(=O)CCn1c(cc2cccc(C#Cc3cnn(C)c3)c2c1=O)[C@H](C)NC(=O)c1c(N)nn2cccnc12
Show InChI InChI=1/C27H27N9O4S/c1-17(32-26(37)23-24(28)33-36-11-5-10-30-25(23)36)21-14-20-7-4-6-19(9-8-18-15-31-34(3)16-18)22(20)27(38)35(21)12-13-41(39,40)29-2/h4-7,10-11,14-17,29H,12-13H2,1-3H3,(H2,28,33)(H,32,37)/t17-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342552
PNG
(US10329299, Compound 103 | US9775844, Compound 103)
Show SMILES CC(C)n1c(cc2cccc(C#Cc3cnn(C)c3)c2c1=O)[C@H](C)NC(=O)c1c(N)nn2cccnc12
Show InChI InChI=1/C27H26N8O2/c1-16(2)35-21(17(3)31-26(36)23-24(28)32-34-12-6-11-29-25(23)34)13-20-8-5-7-19(22(20)27(35)37)10-9-18-14-30-33(4)15-18/h5-8,11-17H,1-4H3,(H2,28,32)(H,31,36)/t17-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM342552
PNG
(US10329299, Compound 103 | US9775844, Compound 103)
Show SMILES CC(C)n1c(cc2cccc(C#Cc3cnn(C)c3)c2c1=O)[C@H](C)NC(=O)c1c(N)nn2cccnc12
Show InChI InChI=1/C27H26N8O2/c1-16(2)35-21(17(3)31-26(36)23-24(28)32-34-12-6-11-29-25(23)34)13-20-8-5-7-19(22(20)27(35)37)10-9-18-14-30-33(4)15-18/h5-8,11-17H,1-4H3,(H2,28,32)(H,31,36)/t17-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM342553
PNG
(US10329299, Compound 104 | US9775844, Compound 104)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1CCS(=O)(=O)N(C)C
Show InChI InChI=1/C28H29N9O4S/c1-18(32-27(38)24-25(29)33-37-12-6-11-30-26(24)37)22-15-21-8-5-7-20(10-9-19-16-31-35(4)17-19)23(21)28(39)36(22)13-14-42(40,41)34(2)3/h5-8,11-12,15-18H,13-14H2,1-4H3,(H2,29,33)(H,32,38)/t18-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM339971
PNG
(US10329299, Compound 1 | US9775844, Compound 1)
Show SMILES CC#Cc1cccc2nc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12
Show InChI InChI=1/C26H21N7O2/c1-3-9-17-10-7-13-19-20(17)26(35)33(18-11-5-4-6-12-18)23(30-19)16(2)29-25(34)21-22(27)31-32-15-8-14-28-24(21)32/h4-8,10-16H,1-2H3,(H2,27,31)(H,29,34)/t16-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM339972
PNG
(US10329299, Compound 2 | US9775844, Compound 2)
Show SMILES CC(C)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12
Show InChI InChI=1/C29H26N6O2/c1-18(2)13-14-20-9-7-10-21-17-23(35(29(37)24(20)21)22-11-5-4-6-12-22)19(3)32-28(36)25-26(30)33-34-16-8-15-31-27(25)34/h4-12,15-19H,1-3H3,(H2,30,33)(H,32,36)/t19-/s2
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Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50192880
PNG
(CHEMBL3984425 | US10329299, Compound 21 | US977584...)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H24N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-22-9-6-8-21(13-12-20-17-33-36(2)18-20)25(22)30(40)38(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,31,35)(H,34,39)/t19-/s2
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Article
US Patent
n/an/a 2.00E+3n/an/an/an/an/an/a



Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM340014
PNG
(US10329299, Compound 6 | US9775844, Compound 6)
Show SMILES COc1ccc(cn1)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12
Show InChI InChI=1/C32H25N7O3/c1-20(36-31(40)28-29(33)37-38-17-7-16-34-30(28)38)25-18-23-9-6-8-22(14-12-21-13-15-26(42-2)35-19-21)27(23)32(41)39(25)24-10-4-3-5-11-24/h3-11,13,15-20H,1-2H3,(H2,33,37)(H,36,40)/t20-/s2
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Article
US Patent
n/an/a 2.00E+3n/an/an/an/an/an/a



Infinity Pharmaceuticals Inc

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9775844 (2017)


Article DOI: 10.1021/jm030603w
BindingDB Entry DOI: 10.7270/Q2GQ70WH
More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%