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Compile Data Set for Download or QSAR

Found 1473 hits with Last Name = 'bharathan' and Initial = 'i'   
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
Cannabinoid receptor 2


(MOUSE)
BDBM60536
PNG
(BDBM50399283 | US9102622, 13.2)
Show SMILES FS(=O)(=O)CCCCCCCc1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C20H25FO3S/c21-25(22,23)15-8-3-1-2-5-10-18-13-9-14-20(16-18)24-17-19-11-6-4-7-12-19/h4,6-7,9,11-14,16H,1-3,5,8,10,15,17H2
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99n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in HEK293 cells


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50399279
PNG
(CHEMBL2180822)
Show SMILES FS(=O)(=O)CCCCOc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C17H19FO4S/c18-23(19,20)13-5-4-12-21-16-8-10-17(11-9-16)22-14-15-6-2-1-3-7-15/h1-3,6-11H,4-5,12-14H2
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104n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor in rat brain homogenates


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50399282
PNG
(CHEMBL2180817 | US9102622, 13.4)
Show SMILES FS(=O)(=O)CCCCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C18H21FO3S/c19-23(20,21)14-6-2-5-7-16-10-12-18(13-11-16)22-15-17-8-3-1-4-9-17/h1,3-4,8-13H,2,5-7,14-15H2
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118n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor in rat brain homogenates


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50399281
PNG
(CHEMBL2180818 | US9102622, 14.1)
Show SMILES Oc1ccc(CCCCCCCS(F)(=O)=O)cc1
Show InChI InChI=1S/C13H19FO3S/c14-18(16,17)11-5-3-1-2-4-6-12-7-9-13(15)10-8-12/h7-10,15H,1-6,11H2
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163n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor in rat brain homogenates


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50399280
PNG
(CHEMBL2180821 | US9102622, 14.4)
Show SMILES Oc1ccc(CCCCCS(F)(=O)=O)cc1
Show InChI InChI=1S/C11H15FO3S/c12-16(14,15)9-3-1-2-4-10-5-7-11(13)8-6-10/h5-8,13H,1-4,9H2
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192n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor in rat brain homogenates


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50399282
PNG
(CHEMBL2180817 | US9102622, 13.4)
Show SMILES FS(=O)(=O)CCCCCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C18H21FO3S/c19-23(20,21)14-6-2-5-7-16-10-12-18(13-11-16)22-15-17-8-3-1-4-9-17/h1,3-4,8-13H,2,5-7,14-15H2
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194n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in HEK293 cells


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50399279
PNG
(CHEMBL2180822)
Show SMILES FS(=O)(=O)CCCCOc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C17H19FO4S/c18-23(19,20)13-5-4-12-21-16-8-10-17(11-9-16)22-14-15-6-2-1-3-7-15/h1-3,6-11H,4-5,12-14H2
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203n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in HEK293 cells


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM60536
PNG
(BDBM50399283 | US9102622, 13.2)
Show SMILES FS(=O)(=O)CCCCCCCc1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C20H25FO3S/c21-25(22,23)15-8-3-1-2-5-10-18-13-9-14-20(16-18)24-17-19-11-6-4-7-12-19/h4,6-7,9,11-14,16H,1-3,5,8,10,15,17H2
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335n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from CB1 receptor in rat brain homogenates


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50399280
PNG
(CHEMBL2180821 | US9102622, 14.4)
Show SMILES Oc1ccc(CCCCCS(F)(=O)=O)cc1
Show InChI InChI=1S/C11H15FO3S/c12-16(14,15)9-3-1-2-4-10-5-7-11(13)8-6-10/h5-8,13H,1-4,9H2
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577n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in HEK293 cells


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(MOUSE)
BDBM50399281
PNG
(CHEMBL2180818 | US9102622, 14.1)
Show SMILES Oc1ccc(CCCCCCCS(F)(=O)=O)cc1
Show InChI InChI=1S/C13H19FO3S/c14-18(16,17)11-5-3-1-2-4-6-12-7-9-13(15)10-8-12/h7-10,15H,1-6,11H2
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698n/an/an/an/an/an/an/an/a



Northeastern University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in HEK293 cells


J Med Chem 55: 10074-89 (2012)


Article DOI: 10.1021/jm301205j
BindingDB Entry DOI: 10.7270/Q2J967HK
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50362985
PNG
(CHEMBL1945502)
Show SMILES COc1ccc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)cc1CCCN(C)C
Show InChI InChI=1S/C24H26ClN5OS/c1-30(2)10-4-5-15-11-18(7-9-21(15)31-3)27-24-26-14-16-12-22(32)28-20-13-17(25)6-8-19(20)23(16)29-24/h6-9,11,13-14H,4-5,10,12H2,1-3H3,(H,28,32)(H,26,27,29)
PDB
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n/an/a 1n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of KDR


J Med Chem 55: 197-208 (2012)


Article DOI: 10.1021/jm2011172
BindingDB Entry DOI: 10.7270/Q21C1XBR
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK3


(Homo sapiens (Human))
BDBM50362985
PNG
(CHEMBL1945502)
Show SMILES COc1ccc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)cc1CCCN(C)C
Show InChI InChI=1S/C24H26ClN5OS/c1-30(2)10-4-5-15-11-18(7-9-21(15)31-3)27-24-26-14-16-12-22(32)28-20-13-17(25)6-8-19(20)23(16)29-24/h6-9,11,13-14H,4-5,10,12H2,1-3H3,(H,28,32)(H,26,27,29)
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n/an/a 5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of PLK3


J Med Chem 55: 197-208 (2012)


Article DOI: 10.1021/jm2011172
BindingDB Entry DOI: 10.7270/Q21C1XBR
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK3


(Homo sapiens (Human))
BDBM50362988
PNG
(CHEMBL1945500)
Show SMILES CN(C)CCCc1cc(Cl)cc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)c1
Show InChI InChI=1S/C23H23Cl2N5S/c1-30(2)7-3-4-14-8-17(25)11-18(9-14)27-23-26-13-15-10-21(31)28-20-12-16(24)5-6-19(20)22(15)29-23/h5-6,8-9,11-13H,3-4,7,10H2,1-2H3,(H,28,31)(H,26,27,29)
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n/an/a 5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of PLK3


J Med Chem 55: 197-208 (2012)


Article DOI: 10.1021/jm2011172
BindingDB Entry DOI: 10.7270/Q21C1XBR
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK3


(Homo sapiens (Human))
BDBM50362986
PNG
(CHEMBL1945501)
Show SMILES CN(C)CCCc1cc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)ccc1F
Show InChI InChI=1S/C23H23ClFN5S/c1-30(2)9-3-4-14-10-17(6-8-19(14)25)27-23-26-13-15-11-21(31)28-20-12-16(24)5-7-18(20)22(15)29-23/h5-8,10,12-13H,3-4,9,11H2,1-2H3,(H,28,31)(H,26,27,29)
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n/an/a 7n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of PLK3


J Med Chem 55: 197-208 (2012)


Article DOI: 10.1021/jm2011172
BindingDB Entry DOI: 10.7270/Q21C1XBR
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK3


(Homo sapiens (Human))
BDBM50362984
PNG
(CHEMBL1945801)
Show SMILES CN(C)CCCc1cc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)ccc1C(F)(F)F
Show InChI InChI=1S/C24H23ClF3N5S/c1-33(2)9-3-4-14-10-17(6-8-19(14)24(26,27)28)30-23-29-13-15-11-21(34)31-20-12-16(25)5-7-18(20)22(15)32-23/h5-8,10,12-13H,3-4,9,11H2,1-2H3,(H,31,34)(H,29,30,32)
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n/an/a 9n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of PLK3


J Med Chem 55: 197-208 (2012)


Article DOI: 10.1021/jm2011172
BindingDB Entry DOI: 10.7270/Q21C1XBR
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337923
PNG
(US9751854, Compound I-104 | US9802960, Compound I-...)
Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337926
PNG
(US9751854, Compound I-107 | US9802960, Compound I-...)
Show SMILES COc1ncc(cc1S(=O)(=O)Nc1ccc(F)cc1F)-c1ccnc(NC(C)=O)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337928
PNG
(US9751854, Compound I-109 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccccc2Cl)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337929
PNG
(US9751854, Compound I-110 | US9802960, Compound I-...)
Show SMILES CN(CC1CC1)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337930
PNG
(US9751854, Compound I-111 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337932
PNG
(US9751854, Compound I-113 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2Cl)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337943
PNG
(US9751854, Compound I-119 | US9802960, Compound I-...)
Show SMILES CN(C)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337944
PNG
(US9751854, Compound I-120 | US9802960, Compound I-...)
Show SMILES CCN(CC)S(=O)(=O)c1cncc(c1)-c1ccnc(NC(C)=O)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337947
PNG
(US9751854, Compound I-123 | US9802960, Compound I-...)
Show SMILES COc1cccc(c1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337948
PNG
(US9751854, Compound I-124 | US9802960, Compound I-...)
Show SMILES CCN(CC)S(=O)(=O)c1cc(cnc1N)-c1ccnc(NC(C)=O)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337949
PNG
(US9751854, Compound I-125 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)N1Cc2ccccc2C1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337952
PNG
(US9751854, Compound I-128 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(C)cc2Cl)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337955
PNG
(US9751854, Compound I-131 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337956
PNG
(US9751854, Compound I-132 | US9802960, Compound I-...)
Show SMILES CNc1ncc(cc1N1CCCS1(=O)=O)-c1ccnc(NC(C)=O)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337957
PNG
(US9751854, Compound I-133 | US9802960, Compound I-...)
Show SMILES CN(c1cc(cnc1N)-c1ccnc(NC(C)=O)c1)S(C)(=O)=O
PDB
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337960
PNG
(US9751854, Compound I-136 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)C(=O)Nc1ccccc1Cl
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337965
PNG
(US9751854, Compound I-141 | US9802960, Compound I-...)
Show SMILES CNc1ncc(cc1N(CC1CC1)S(C)(=O)=O)-c1ccnc(NC(C)=O)c1
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337966
PNG
(US9751854, Compound I-142 | US9802960, Compound I-...)
Show SMILES COc1cc(C)ccc1S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337967
PNG
(US9751854, Compound I-143 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cc(ccc2F)C(F)(F)F)c1
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337968
PNG
(US9751854, Compound I-144 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccccc2F)c1
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337971
PNG
(US9751854, Compound I-147 | US9802960, Compound I-...)
Show SMILES CNc1ncc(cc1N(C)S(C)(=O)=O)-c1ccnc(NC(C)=O)c1
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337974
PNG
(US9751854, Compound I-150 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2c(F)cccc2F)c1
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337977
PNG
(US9751854, Compound I-153 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2F)c1C
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337978
PNG
(US9751854, Compound I-154 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(Cl)cc2)c1
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337979
PNG
(US9751854, Compound I-155 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc(F)c2)c1
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337980
PNG
(US9751854, Compound I-156 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)N1CCCCC1
PDB
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n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337982
PNG
(US9751854, Compound I-158 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc2[nH]cc(c2c1)S(=O)(=O)N1CCCC1
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337983
PNG
(US9751854, Compound I-159 | US9802960, Compound I-...)
Show SMILES COc1cc(F)c(cc1F)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337985
PNG
(US9751854, Compound I-161 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(c(F)cn1)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337987
PNG
(US9751854, Compound I-163 | US9802960, Compound I-...)
Show SMILES COc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337988
PNG
(US9751854, Compound I-164 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(F)c(NS(=O)(=O)c2ccc(F)cc2F)c1
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337989
PNG
(US9751854, Compound I-165 | US9802960, Compound I-...)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C)-c1ccnc(NC(C)=O)c1
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337990
PNG
(US9751854, Compound I-166 | US9802960, Compound I-...)
Show SMILES CN(C)S(=O)(=O)c1cc(cnc1N)-c1ccnc(Nc2ncco2)c1
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337992
PNG
(US9751854, Compound I-168 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c1
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM337994
PNG
(US9751854, Compound I-170 | US9802960, Compound I-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(N)c(c1)S(=O)(=O)Nc1ccc(F)cc1F
PDB
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Millennium Pharmaceuticals, Inc.

US Patent




US Patent US9802960 (2017)

More data for this
Ligand-Target Pair
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