Found 24 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 3-kinase catalytic subunit type 3
(Homo sapiens (Human)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of human VPS34 |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit beta
(Homo sapiens (Human)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 437 | n/a | n/a | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of PI3K C2beta |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 922 | n/a | n/a | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of P110alpha/p85alpha |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit alpha
(Homo sapiens (Human)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | PDB
UniProtKB/SwissProt
antibodypedia
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| Purchase
CHEMBL
PC cid
PC sid
UniChem
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Similars
| Article
PubMed
| n/a | n/a | 1.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of PI3K C2alpha |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of P110delta/p85alpha |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of P110gamma |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4-kinase beta
(Homo sapiens (Human)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
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CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.44E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of PI4K beta |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4-kinase alpha
(Homo sapiens (Human)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of PI4K alpha |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346969
(CHEMBL1795883)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1 Show InChI InChI=1S/C35H29F3N6O2/c1-43-14-12-26(13-15-43)42-34(46)22-4-2-21(3-5-22)28-9-8-27(17-30(28)35(36,37)38)44-32(45)11-7-24-18-39-31-10-6-23(16-29(31)33(24)44)25-19-40-41-20-25/h2-11,16-20,26H,12-15H2,1H3,(H,40,41)(H,42,46) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 10 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346971
(CHEMBL1795885)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1 Show InChI InChI=1S/C35H32N6O2/c1-22-17-29(9-10-30(22)23-3-5-24(6-4-23)35(43)39-28-13-15-40(2)16-14-28)41-33(42)12-8-26-19-36-32-11-7-25(18-31(32)34(26)41)27-20-37-38-21-27/h3-12,17-21,28H,13-16H2,1-2H3,(H,37,38)(H,39,43) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 150 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346974
(CHEMBL1795888)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccccc21 Show InChI InChI=1S/C32H30N4O2/c1-21-19-26(36-30(37)14-11-24-20-33-29-6-4-3-5-28(29)31(24)36)12-13-27(21)22-7-9-23(10-8-22)32(38)34-25-15-17-35(2)18-16-25/h3-14,19-20,25H,15-18H2,1-2H3,(H,34,38) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346975
(CHEMBL1795889)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc(N)nc1 Show InChI InChI=1S/C37H34N6O2/c1-23-19-30(10-11-31(23)24-3-5-25(6-4-24)37(45)41-29-15-17-42(2)18-16-29)43-35(44)14-9-28-22-39-33-12-7-26(20-32(33)36(28)43)27-8-13-34(38)40-21-27/h3-14,19-22,29H,15-18H2,1-2H3,(H2,38,40)(H,41,45) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 50 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346967
(CHEMBL1795881)Show SMILES NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C35H21F3N4O2/c36-35(37,38)29-17-26(11-12-27(29)20-5-7-21(8-6-20)34(39)44)42-32(43)14-10-24-18-41-31-13-9-22(16-28(31)33(24)42)25-15-23-3-1-2-4-30(23)40-19-25/h1-19H,(H2,39,44) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 25 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346968
(CHEMBL1795882)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc(N)nc1 Show InChI InChI=1S/C36H30F3N7O2/c1-45-14-12-26(13-15-45)44-34(48)22-4-2-21(3-5-22)28-9-8-27(17-30(28)36(37,38)39)46-32(47)11-7-24-18-41-31-10-6-23(16-29(31)33(24)46)25-19-42-35(40)43-20-25/h2-11,16-20,26H,12-15H2,1H3,(H,44,48)(H2,40,42,43) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 10 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346961
(CHEMBL1795875)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H32F3N5O2/c1-48-18-16-31(17-19-48)47-40(51)26-8-6-25(7-9-26)33-13-12-32(22-35(33)41(42,43)44)49-38(50)15-11-29-23-46-37-14-10-27(21-34(37)39(29)49)30-20-28-4-2-3-5-36(28)45-24-30/h2-15,20-24,31H,16-19H2,1H3,(H,47,51) | PDB
UniProtKB/SwissProt
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PC cid
PC sid
UniChem
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Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 5 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346964
(CHEMBL1795878)Show SMILES OCc1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C35H22F3N3O2/c36-35(37,38)30-17-27(11-12-28(30)22-7-5-21(20-42)6-8-22)41-33(43)14-10-25-18-40-32-13-9-23(16-29(32)34(25)41)26-15-24-3-1-2-4-31(24)39-19-26/h1-19,42H,20H2 | PDB
UniProtKB/SwissProt
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PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 30 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346963
(CHEMBL1795877)Show SMILES FC(F)(F)c1cc(ccc1-c1ccc(COC2CCCCO2)cc1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C40H30F3N3O3/c41-40(42,43)34-21-31(14-15-32(34)26-10-8-25(9-11-26)24-49-38-7-3-4-18-48-38)46-37(47)17-13-29-22-45-36-16-12-27(20-33(36)39(29)46)30-19-28-5-1-2-6-35(28)44-23-30/h1-2,5-6,8-17,19-23,38H,3-4,7,18,24H2 | PDB
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 25 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346973
(CHEMBL1795887)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2[nH]ccc2c1 Show InChI InChI=1S/C39H34N6O2/c1-24-19-32(9-10-33(24)25-3-5-26(6-4-25)39(47)43-31-14-17-44(2)18-15-31)45-36(46)12-8-29-22-41-35-11-7-27(21-34(35)37(29)45)30-20-28-13-16-40-38(28)42-23-30/h3-13,16,19-23,31H,14-15,17-18H2,1-2H3,(H,40,42)(H,43,47) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 25 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346962
(CHEMBL1795876)Show SMILES CNC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C36H23F3N4O2/c1-40-35(45)22-8-6-21(7-9-22)28-13-12-27(18-30(28)36(37,38)39)43-33(44)15-11-25-19-42-32-14-10-23(17-29(32)34(25)43)26-16-24-4-2-3-5-31(24)41-20-26/h2-20H,1H3,(H,40,45) | PDB
UniProtKB/SwissProt
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 15 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346972
(CHEMBL1795886)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnn(C)c1 Show InChI InChI=1S/C36H34N6O2/c1-23-18-30(10-11-31(23)24-4-6-25(7-5-24)36(44)39-29-14-16-40(2)17-15-29)42-34(43)13-9-27-20-37-33-12-8-26(19-32(33)35(27)42)28-21-38-41(3)22-28/h4-13,18-22,29H,14-17H2,1-3H3,(H,39,44) | PDB
UniProtKB/SwissProt
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 150 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346970
(CHEMBL1795884)Show SMILES CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C41H35N5O2/c1-26-21-34(13-14-35(26)27-7-9-28(10-8-27)41(48)44-33-17-19-45(2)20-18-33)46-39(47)16-12-31-24-43-38-15-11-29(23-36(38)40(31)46)32-22-30-5-3-4-6-37(30)42-25-32/h3-16,21-25,33H,17-20H2,1-2H3,(H,44,48) | PDB
UniProtKB/SwissProt
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PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | n/a | n/a | 1 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346966
(CHEMBL1795880)Show SMILES COC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C36H22F3N3O3/c1-45-35(44)22-8-6-21(7-9-22)28-13-12-27(18-30(28)36(37,38)39)42-33(43)15-11-25-19-41-32-14-10-23(17-29(32)34(25)42)26-16-24-4-2-3-5-31(24)40-20-26/h2-20H,1H3 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 200 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Mus musculus (Mouse)) | BDBM50346965
(CHEMBL1795879)Show SMILES OC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 Show InChI InChI=1S/C35H20F3N3O3/c36-35(37,38)29-17-26(11-12-27(29)20-5-7-21(8-6-20)34(43)44)41-32(42)14-10-24-18-40-31-13-9-22(16-28(31)33(24)41)25-15-23-3-1-2-4-30(23)39-19-25/h1-19H,(H,43,44) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 20 | n/a | n/a | n/a | n/a |
Dana Farber Cancer Institute
Curated by ChEMBL
| Assay Description
Inhibition of mTOR-dependent S6K phosphorylation at T389 residue in MEF cells |
Bioorg Med Chem Lett 21: 4036-40 (2011)
Article DOI: 10.1016/j.bmcl.2011.04.129
BindingDB Entry DOI: 10.7270/Q2Z60PD1 |
More data for this
Ligand-Target Pair | |
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