Found 15 hits Enz. Inhib. hit(s) with all data for entry = 50001375 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)) | BDBM172639
(US9090628, 299)Show SMILES CC(C)n1nc(C)nc1-c1cn2CCOc3cc(C)c(cc3-c2n1)[C@@H](C)N1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C28H41N7O/c1-18(2)35-27(29-21(5)31-35)24-17-33-13-14-36-25-15-19(3)22(16-23(25)26(33)30-24)20(4)32-9-11-34(12-10-32)28(6,7)8/h15-18,20H,9-14H2,1-8H3/t20-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.480 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172634
(US9090628, 294)Show SMILES CC(C)n1nc(C)nc1-c1cn2CCOc3cc(F)c(cc3-c2n1)[C@@H](C)N1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C27H38FN7O/c1-17(2)35-26(29-19(4)31-35)23-16-33-12-13-36-24-15-22(28)20(14-21(24)25(33)30-23)18(3)32-8-10-34(11-9-32)27(5,6)7/h14-18H,8-13H2,1-7H3/t18-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.780 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50278665
(CHEMBL4175041)Show SMILES CC(C)n1ncnc1-c1cn2CCOc3ccc(cc3-c2n1)[S@@+]([O-])C1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C25H34N6O2S/c1-17(2)31-24(26-16-27-31)21-15-29-12-13-33-22-7-6-19(14-20(22)23(29)28-21)34(32)18-8-10-30(11-9-18)25(3,4)5/h6-7,14-18H,8-13H2,1-5H3/t34-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.810 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172640
(US9090628, 300)Show SMILES CC(C)n1nc(C)nc1-c1cn2CCOc3cc(C)c(cc3-c2n1)[C@H](C)N1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C28H41N7O/c1-18(2)35-27(29-21(5)31-35)24-17-33-13-14-36-25-15-19(3)22(16-23(25)26(33)30-24)20(4)32-9-11-34(12-10-32)28(6,7)8/h15-18,20H,9-14H2,1-8H3/t20-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.880 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50278667
(CHEMBL4167171)Show SMILES CC(C)n1ncnc1-c1cn2CCOc3ccc(cc3-c2n1)S(=O)(=O)N1CCN(CC1)C(C)(C)C Show InChI InChI=1S/C24H33N7O3S/c1-17(2)31-23(25-16-26-31)20-15-28-12-13-34-21-7-6-18(14-19(21)22(28)27-20)35(32,33)30-10-8-29(9-11-30)24(3,4)5/h6-7,14-17H,8-13H2,1-5H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172467
(US9090628, 110)Show SMILES CC(C)n1ncnc1-c1cn2CCOc3ccc(cc3-c2n1)C(=O)N1CCN(CC1)C(C)(C)C Show InChI InChI=1S/C25H33N7O2/c1-17(2)32-23(26-16-27-32)20-15-30-12-13-34-21-7-6-18(14-19(21)22(30)28-20)24(33)29-8-10-31(11-9-29)25(3,4)5/h6-7,14-17H,8-13H2,1-5H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172643
(US9090628, 303)Show SMILES CC(C)n1nc(C)nc1-c1cn2CCOc3cnc(cc3-c2n1)[C@H](C)N1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C26H38N8O/c1-17(2)34-25(28-19(4)30-34)22-16-32-12-13-35-23-15-27-21(14-20(23)24(32)29-22)18(3)31-8-10-33(11-9-31)26(5,6)7/h14-18H,8-13H2,1-7H3/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172637
(US9090628, 297)Show SMILES CC(C)n1nc(C)nc1-c1cn2CCOc3cc(F)c(cc3-c2n1)[C@H](C)N1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C27H38FN7O/c1-17(2)35-26(29-19(4)31-35)23-16-33-12-13-36-24-15-22(28)20(14-21(24)25(33)30-23)18(3)32-8-10-34(11-9-32)27(5,6)7/h14-18H,8-13H2,1-7H3/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172465
(US9090628, 108)Show SMILES CC(C)n1ncnc1-c1cn2CCOc3ccc(CN4CCN(CC4)C(C)(C)C)cc3-c2n1 Show InChI InChI=1S/C25H35N7O/c1-18(2)32-24(26-17-27-32)21-16-30-12-13-33-22-7-6-19(14-20(22)23(30)28-21)15-29-8-10-31(11-9-29)25(3,4)5/h6-7,14,16-18H,8-13,15H2,1-5H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172645
(US9090628, 305)Show SMILES CC(C)n1nc(C)nc1-c1cn2CCOc3cnc(cc3-c2n1)[C@@H](C)N1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C26H38N8O/c1-17(2)34-25(28-19(4)30-34)22-16-32-12-13-35-23-15-27-21(14-20(23)24(32)29-22)18(3)31-8-10-33(11-9-31)26(5,6)7/h14-18H,8-13H2,1-7H3/t18-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50278666
(CHEMBL4170565)Show SMILES CC(C)n1ncnc1-c1cn2CCOc3ccc(cc3-c2n1)[S@+]([O-])C1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C25H34N6O2S/c1-17(2)31-24(26-16-27-31)21-15-29-12-13-33-22-7-6-19(14-20(22)23(29)28-21)34(32)18-8-10-30(11-9-18)25(3,4)5/h6-7,14-18H,8-13H2,1-5H3/t34-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50278664
(CHEMBL4168260)Show SMILES CC(C)n1ncnc1-c1cn2CCOc3ccc(CN4CCC(CC4)C(C)(C)O)cc3-c2n1 Show InChI InChI=1S/C25H34N6O2/c1-17(2)31-24(26-16-27-31)21-15-30-11-12-33-22-6-5-18(13-20(22)23(30)28-21)14-29-9-7-19(8-10-29)25(3,4)32/h5-6,13,15-17,19,32H,7-12,14H2,1-4H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Binding affinity to PI3Kdelta (unknown origin) |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172639
(US9090628, 299)Show SMILES CC(C)n1nc(C)nc1-c1cn2CCOc3cc(C)c(cc3-c2n1)[C@@H](C)N1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C28H41N7O/c1-18(2)35-27(29-21(5)31-35)24-17-33-13-14-36-25-15-19(3)22(16-23(25)26(33)30-24)20(4)32-9-11-34(12-10-32)28(6,7)8/h15-18,20H,9-14H2,1-8H3/t20-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta in human whole blood assessed as suppression of CD69 expression |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172634
(US9090628, 294)Show SMILES CC(C)n1nc(C)nc1-c1cn2CCOc3cc(F)c(cc3-c2n1)[C@@H](C)N1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C27H38FN7O/c1-17(2)35-26(29-19(4)31-35)23-16-33-12-13-36-24-15-22(28)20(14-21(24)25(33)30-23)18(3)32-8-10-34(11-9-32)27(5,6)7/h14-18H,8-13H2,1-7H3/t18-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta in human whole blood assessed as suppression of CD69 expression |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM172643
(US9090628, 303)Show SMILES CC(C)n1nc(C)nc1-c1cn2CCOc3cnc(cc3-c2n1)[C@H](C)N1CCN(CC1)C(C)(C)C |r| Show InChI InChI=1S/C26H38N8O/c1-17(2)34-25(28-19(4)30-34)22-16-32-12-13-35-23-15-27-21(14-20(23)24(32)29-22)18(3)31-8-10-33(11-9-31)26(5,6)7/h14-18H,8-13H2,1-7H3/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Genentech
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta in human whole blood assessed as suppression of CD69 expression |
ACS Med Chem Lett 8: 936-940 (2017)
Article DOI: 10.1021/acsmedchemlett.7b00170
BindingDB Entry DOI: 10.7270/Q2CV4M7R |
More data for this
Ligand-Target Pair | |
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