Found 27 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 |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM25045
(3-(4-morpholin-4-ylpyrido[2,3]furo[2,4-b]pyrimidin...)Show InChI InChI=1S/C19H16N4O3/c24-13-4-1-3-12(11-13)17-21-15-14-5-2-6-20-19(14)26-16(15)18(22-17)23-7-9-25-10-8-23/h1-6,11,24H,7-10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of PI3Kdelta (unknown origin) after 1 hr by ADP-Glo Luminescent assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM25045
(3-(4-morpholin-4-ylpyrido[2,3]furo[2,4-b]pyrimidin...)Show InChI InChI=1S/C19H16N4O3/c24-13-4-1-3-12(11-13)17-21-15-14-5-2-6-20-19(14)26-16(15)18(22-17)23-7-9-25-10-8-23/h1-6,11,24H,7-10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of PI3Kalpha (unknown origin) after 1 hr by Kinase-Glo Luminescent assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
(Homo sapiens (Human)) | BDBM25045
(3-(4-morpholin-4-ylpyrido[2,3]furo[2,4-b]pyrimidin...)Show InChI InChI=1S/C19H16N4O3/c24-13-4-1-3-12(11-13)17-21-15-14-5-2-6-20-19(14)26-16(15)18(22-17)23-7-9-25-10-8-23/h1-6,11,24H,7-10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of PI3Kbeta (unknown origin) after 1 hr by ADP-Glo Luminescent assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499377
(CHEMBL3735194)Show SMILES Cl.NC(=O)c1cnc2ccc(cc2c1Nc1ccc(N2CCNCC2)c(c1)C(F)(F)F)-c1cnc2ccccc2c1 Show InChI InChI=1S/C30H25F3N6O/c31-30(32,33)24-15-21(6-8-27(24)39-11-9-35-10-12-39)38-28-22-14-18(5-7-26(22)37-17-23(28)29(34)40)20-13-19-3-1-2-4-25(19)36-16-20/h1-8,13-17,35H,9-12H2,(H2,34,40)(H,37,38) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM25045
(3-(4-morpholin-4-ylpyrido[2,3]furo[2,4-b]pyrimidin...)Show InChI InChI=1S/C19H16N4O3/c24-13-4-1-3-12(11-13)17-21-15-14-5-2-6-20-19(14)26-16(15)18(22-17)23-7-9-25-10-8-23/h1-6,11,24H,7-10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM92862
(US9284315, BEZ-235 | mTOR Inhibitor, BEZ235)Show SMILES Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1cnc2ccccc2c1 Show InChI InChI=1S/C30H23N5O/c1-30(2,18-31)22-9-11-23(12-10-22)35-28-24-15-19(21-14-20-6-4-5-7-25(20)32-16-21)8-13-26(24)33-17-27(28)34(3)29(35)36/h4-17H,1-3H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499372
(CHEMBL3736495)Show SMILES CCC(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2ccc(N)nc2)C(N)=O)cc1C(F)(F)F Show InChI InChI=1S/C29H28F3N7O2/c1-2-26(40)39-11-9-38(10-12-39)24-7-5-19(14-22(24)29(30,31)32)37-27-20-13-17(18-4-8-25(33)36-15-18)3-6-23(20)35-16-21(27)28(34)41/h3-8,13-16H,2,9-12H2,1H3,(H2,33,36)(H2,34,41)(H,35,37) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499387
(CHEMBL3736442)Show SMILES CN1CCN(CC(=O)N2CCN(CC2)c2ccc(Nc3c(cnc4ccc(cc34)-c3cnc4ccccc4c3)C(N)=O)cc2C(F)(F)F)CC1 Show InChI InChI=1S/C37H37F3N8O2/c1-45-10-12-46(13-11-45)23-34(49)48-16-14-47(15-17-48)33-9-7-27(20-30(33)37(38,39)40)44-35-28-19-24(6-8-32(28)43-22-29(35)36(41)50)26-18-25-4-2-3-5-31(25)42-21-26/h2-9,18-22H,10-17,23H2,1H3,(H2,41,50)(H,43,44) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499385
(CHEMBL3736038)Show SMILES CC(C)(C#N)c1ccc(Nc2c(cnc3ccc(cc23)-c2ccc(N)nc2)C(N)=O)cc1 Show InChI InChI=1S/C25H22N6O/c1-25(2,14-26)17-5-7-18(8-6-17)31-23-19-11-15(16-4-10-22(27)30-12-16)3-9-21(19)29-13-20(23)24(28)32/h3-13H,1-2H3,(H2,27,30)(H2,28,32)(H,29,31) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499373
(CHEMBL3735090)Show SMILES CC(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1C(F)(F)F Show InChI InChI=1S/C32H27F3N6O2/c1-19(42)40-10-12-41(13-11-40)29-9-7-23(16-26(29)32(33,34)35)39-30-24-15-20(6-8-28(24)38-18-25(30)31(36)43)22-14-21-4-2-3-5-27(21)37-17-22/h2-9,14-18H,10-13H2,1H3,(H2,36,43)(H,38,39) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499384
(CHEMBL3736298)Show SMILES CC(C)(C#N)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1 Show InChI InChI=1S/C29H23N5O/c1-29(2,17-30)21-8-10-22(11-9-21)34-27-23-14-18(7-12-26(23)33-16-24(27)28(31)35)20-13-19-5-3-4-6-25(19)32-15-20/h3-16H,1-2H3,(H2,31,35)(H,33,34) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM25045
(3-(4-morpholin-4-ylpyrido[2,3]furo[2,4-b]pyrimidin...)Show InChI InChI=1S/C19H16N4O3/c24-13-4-1-3-12(11-13)17-21-15-14-5-2-6-20-19(14)26-16(15)18(22-17)23-7-9-25-10-8-23/h1-6,11,24H,7-10H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of PI3Kgamma (unknown origin) after 1 hr by ADP-Glo Luminescent assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499374
(CHEMBL3735478)Show SMILES NC(=O)c1cnc2ccc(cc2c1Nc1cccc(c1)C(F)(F)F)-c1ccc(N)nc1 Show InChI InChI=1S/C22H16F3N5O/c23-22(24,25)14-2-1-3-15(9-14)30-20-16-8-12(13-5-7-19(26)29-10-13)4-6-18(16)28-11-17(20)21(27)31/h1-11H,(H2,26,29)(H2,27,31)(H,28,30) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499379
(CHEMBL3735667)Show SMILES CS(=O)(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1C(F)(F)F Show InChI InChI=1S/C31H27F3N6O3S/c1-44(42,43)40-12-10-39(11-13-40)28-9-7-22(16-25(28)31(32,33)34)38-29-23-15-19(6-8-27(23)37-18-24(29)30(35)41)21-14-20-4-2-3-5-26(20)36-17-21/h2-9,14-18H,10-13H2,1H3,(H2,35,41)(H,37,38) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 73 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499381
(CHEMBL3736275)Show SMILES CNC(=O)c1cnc2ccc(cc2c1Nc1ccc(cc1)C(C)(C)C#N)-c1ccc(N)nc1 Show InChI InChI=1S/C26H24N6O/c1-26(2,15-27)18-6-8-19(9-7-18)32-24-20-12-16(17-5-11-23(28)31-13-17)4-10-22(20)30-14-21(24)25(33)29-3/h4-14H,1-3H3,(H2,28,31)(H,29,33)(H,30,32) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499375
(CHEMBL3736372)Show SMILES Cl.COc1ccc(cn1)-c1ccc2ncc(C(N)=O)c(Nc3ccc(N4CCNCC4)c(c3)C(F)(F)F)c2c1 Show InChI InChI=1S/C27H25F3N6O2/c1-38-24-7-3-17(14-34-24)16-2-5-22-19(12-16)25(20(15-33-22)26(31)37)35-18-4-6-23(21(13-18)27(28,29)30)36-10-8-32-9-11-36/h2-7,12-15,32H,8-11H2,1H3,(H2,31,37)(H,33,35) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 284 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499386
(CHEMBL3735791)Show SMILES NC(=O)c1cnc2ccc(cc2c1Nc1cccc(c1)C(F)(F)F)-c1cnc2ccccc2c1 Show InChI InChI=1S/C26H17F3N4O/c27-26(28,29)18-5-3-6-19(12-18)33-24-20-11-15(8-9-23(20)32-14-21(24)25(30)34)17-10-16-4-1-2-7-22(16)31-13-17/h1-14H,(H2,30,34)(H,32,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 361 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499371
(CHEMBL3735181)Show SMILES CNC(=O)c1cnc2ccc(cc2c1Nc1ccc(cc1)C(C)(C)C#N)-c1cnc2ccccc2c1 Show InChI InChI=1S/C30H25N5O/c1-30(2,18-31)22-9-11-23(12-10-22)35-28-24-15-19(8-13-27(24)34-17-25(28)29(36)32-3)21-14-20-6-4-5-7-26(20)33-16-21/h4-17H,1-3H3,(H,32,36)(H,34,35) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 514 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499378
(CHEMBL3734962)Show SMILES COc1ccc(cn1)-c1ccc2ncc(C(N)=O)c(Nc3ccc(cc3)C(C)(C)C#N)c2c1 Show InChI InChI=1S/C26H23N5O2/c1-26(2,15-27)18-6-8-19(9-7-18)31-24-20-12-16(17-5-11-23(33-3)30-13-17)4-10-22(20)29-14-21(24)25(28)32/h4-14H,1-3H3,(H2,28,32)(H,29,31) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 674 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499376
(CHEMBL3735716)Show SMILES Cl.CNC(=O)c1cnc2ccc(cc2c1Nc1ccc(N2CCNCC2)c(c1)C(F)(F)F)-c1cnc2ccccc2c1 Show InChI InChI=1S/C31H27F3N6O/c1-35-30(41)24-18-38-27-8-6-19(21-14-20-4-2-3-5-26(20)37-17-21)15-23(27)29(24)39-22-7-9-28(25(16-22)31(32,33)34)40-12-10-36-11-13-40/h2-9,14-18,36H,10-13H2,1H3,(H,35,41)(H,38,39) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 806 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50499373
(CHEMBL3735090)Show SMILES CC(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1C(F)(F)F Show InChI InChI=1S/C32H27F3N6O2/c1-19(42)40-10-12-41(13-11-40)29-9-7-23(16-26(29)32(33,34)35)39-30-24-15-20(6-8-28(24)38-18-25(30)31(36)43)22-14-21-4-2-3-5-27(21)37-17-22/h2-9,14-18H,10-13H2,1H3,(H2,36,43)(H,38,39) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 939 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of PI3Kgamma (unknown origin) after 1 hr by ADP-Glo Luminescent assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499382
(CHEMBL3735771)Show SMILES Cn1nccc1-c1ccc2ncc(C(N)=O)c(Nc3ccc(cc3)C(C)(C)C#N)c2c1 Show InChI InChI=1S/C24H22N6O/c1-24(2,14-25)16-5-7-17(8-6-16)29-22-18-12-15(21-10-11-28-30(21)3)4-9-20(18)27-13-19(22)23(26)31/h4-13H,1-3H3,(H2,26,31)(H,27,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499383
(CHEMBL3736052)Show SMILES Cn1nccc1-c1ccc2ncc(C(N)=O)c(Nc3ccc(N4CCN(CC4)S(C)(=O)=O)c(c3)C(F)(F)F)c2c1 Show InChI InChI=1S/C26H26F3N7O3S/c1-34-22(7-8-32-34)16-3-5-21-18(13-16)24(19(15-31-21)25(30)37)33-17-4-6-23(20(14-17)26(27,28)29)35-9-11-36(12-10-35)40(2,38)39/h3-8,13-15H,9-12H2,1-2H3,(H2,30,37)(H,31,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.23E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50499373
(CHEMBL3735090)Show SMILES CC(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1C(F)(F)F Show InChI InChI=1S/C32H27F3N6O2/c1-19(42)40-10-12-41(13-11-40)29-9-7-23(16-26(29)32(33,34)35)39-30-24-15-20(6-8-28(24)38-18-25(30)31(36)43)22-14-21-4-2-3-5-27(21)37-17-22/h2-9,14-18H,10-13H2,1H3,(H2,36,43)(H,38,39) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 2.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of PI3Kalpha (unknown origin) after 1 hr by Kinase-Glo Luminescent assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50499380
(CHEMBL3735998)Show SMILES Cl.FC(F)(F)c1cc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(=O)NC2CC2)ccc1N1CCNCC1 Show InChI InChI=1S/C33H29F3N6O/c34-33(35,36)27-17-24(8-10-30(27)42-13-11-37-12-14-42)40-31-25-16-20(22-15-21-3-1-2-4-28(21)38-18-22)5-9-29(25)39-19-26(31)32(43)41-23-6-7-23/h1-5,8-10,15-19,23,37H,6-7,11-14H2,(H,39,40)(H,41,43) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
(Homo sapiens (Human)) | BDBM50499373
(CHEMBL3735090)Show SMILES CC(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1C(F)(F)F Show InChI InChI=1S/C32H27F3N6O2/c1-19(42)40-10-12-41(13-11-40)29-9-7-23(16-26(29)32(33,34)35)39-30-24-15-20(6-8-28(24)38-18-25(30)31(36)43)22-14-21-4-2-3-5-27(21)37-17-22/h2-9,14-18H,10-13H2,1H3,(H2,36,43)(H,38,39) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of PI3Kbeta (unknown origin) after 1 hr by ADP-Glo Luminescent assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50499373
(CHEMBL3735090)Show SMILES CC(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1C(F)(F)F Show InChI InChI=1S/C32H27F3N6O2/c1-19(42)40-10-12-41(13-11-40)29-9-7-23(16-26(29)32(33,34)35)39-30-24-15-20(6-8-28(24)38-18-25(30)31(36)43)22-14-21-4-2-3-5-27(21)37-17-22/h2-9,14-18H,10-13H2,1H3,(H2,36,43)(H,38,39) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University
Curated by ChEMBL
| Assay Description Inhibition of PI3Kdelta (unknown origin) after 1 hr by ADP-Glo Luminescent assay |
Bioorg Med Chem 23: 7585-96 (2015)
Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM |
More data for this Ligand-Target Pair | |