Found 4 hits for monomerid = 50239399 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Phosphoinositide 3-Kinase (PI3K), delta
(Homo sapiens (Human)) | BDBM50239399
(CHEMBL4069027)Show SMILES C[C@@H](c1nc2cccc(C)c2c(=O)n1-c1ccccc1C)n1cnc2c(N)ncnc12 |r,wD:1.0,(30.32,-29.41,;28.97,-30.16,;27.65,-29.37,;26.31,-30.11,;24.99,-29.33,;23.66,-30.09,;22.33,-29.3,;22.34,-27.77,;23.68,-27,;23.69,-25.46,;25.02,-27.79,;26.35,-27.03,;26.38,-25.49,;27.68,-27.83,;29.02,-27.08,;30.34,-27.88,;31.69,-27.13,;31.71,-25.59,;30.38,-24.79,;29.04,-25.55,;27.72,-24.76,;28.95,-31.7,;30.19,-32.63,;29.69,-34.09,;28.14,-34.06,;27.1,-35.18,;27.55,-36.65,;25.61,-34.84,;25.15,-33.36,;26.21,-32.24,;27.7,-32.59,)| Show InChI InChI=1S/C23H21N7O/c1-13-7-4-5-10-17(13)30-21(28-16-9-6-8-14(2)18(16)23(30)31)15(3)29-12-27-19-20(24)25-11-26-22(19)29/h4-12,15H,1-3H3,(H2,24,25,26)/t15-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length N-terminal His6-tagged PI3K p110delta/p85alpha expressed in baculovirus infected Sf9 insect cells using P... |
J Med Chem 60: 4304-4315 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00247
BindingDB Entry DOI: 10.7270/Q2V40XBD |
More data for this
Ligand-Target Pair | |
Phosphoinositide 3-Kinase (PI3K), delta
(Homo sapiens (Human)) | BDBM50239399
(CHEMBL4069027)Show SMILES C[C@@H](c1nc2cccc(C)c2c(=O)n1-c1ccccc1C)n1cnc2c(N)ncnc12 |r,wD:1.0,(30.32,-29.41,;28.97,-30.16,;27.65,-29.37,;26.31,-30.11,;24.99,-29.33,;23.66,-30.09,;22.33,-29.3,;22.34,-27.77,;23.68,-27,;23.69,-25.46,;25.02,-27.79,;26.35,-27.03,;26.38,-25.49,;27.68,-27.83,;29.02,-27.08,;30.34,-27.88,;31.69,-27.13,;31.71,-25.59,;30.38,-24.79,;29.04,-25.55,;27.72,-24.76,;28.95,-31.7,;30.19,-32.63,;29.69,-34.09,;28.14,-34.06,;27.1,-35.18,;27.55,-36.65,;25.61,-34.84,;25.15,-33.36,;26.21,-32.24,;27.7,-32.59,)| Show InChI InChI=1S/C23H21N7O/c1-13-7-4-5-10-17(13)30-21(28-16-9-6-8-14(2)18(16)23(30)31)15(3)29-12-27-19-20(24)25-11-26-22(19)29/h4-12,15H,1-3H3,(H2,24,25,26)/t15-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length N-terminal His6-tagged PI3K p110delta/p85alpha expressed in baculovirus infected Sf9 insect cells using P... |
J Med Chem 60: 4304-4315 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00247
BindingDB Entry DOI: 10.7270/Q2V40XBD |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50239399
(CHEMBL4069027)Show SMILES C[C@@H](c1nc2cccc(C)c2c(=O)n1-c1ccccc1C)n1cnc2c(N)ncnc12 |r,wD:1.0,(30.32,-29.41,;28.97,-30.16,;27.65,-29.37,;26.31,-30.11,;24.99,-29.33,;23.66,-30.09,;22.33,-29.3,;22.34,-27.77,;23.68,-27,;23.69,-25.46,;25.02,-27.79,;26.35,-27.03,;26.38,-25.49,;27.68,-27.83,;29.02,-27.08,;30.34,-27.88,;31.69,-27.13,;31.71,-25.59,;30.38,-24.79,;29.04,-25.55,;27.72,-24.76,;28.95,-31.7,;30.19,-32.63,;29.69,-34.09,;28.14,-34.06,;27.1,-35.18,;27.55,-36.65,;25.61,-34.84,;25.15,-33.36,;26.21,-32.24,;27.7,-32.59,)| Show InChI InChI=1S/C23H21N7O/c1-13-7-4-5-10-17(13)30-21(28-16-9-6-8-14(2)18(16)23(30)31)15(3)29-12-27-19-20(24)25-11-26-22(19)29/h4-12,15H,1-3H3,(H2,24,25,26)/t15-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta in human PBMC assessed as reduction in anti-human CD28 antibody stimulated IL-6 secretion levels after 72 hrs by ELISA |
J Med Chem 60: 4304-4315 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00247
BindingDB Entry DOI: 10.7270/Q2V40XBD |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50239399
(CHEMBL4069027)Show SMILES C[C@@H](c1nc2cccc(C)c2c(=O)n1-c1ccccc1C)n1cnc2c(N)ncnc12 |r,wD:1.0,(30.32,-29.41,;28.97,-30.16,;27.65,-29.37,;26.31,-30.11,;24.99,-29.33,;23.66,-30.09,;22.33,-29.3,;22.34,-27.77,;23.68,-27,;23.69,-25.46,;25.02,-27.79,;26.35,-27.03,;26.38,-25.49,;27.68,-27.83,;29.02,-27.08,;30.34,-27.88,;31.69,-27.13,;31.71,-25.59,;30.38,-24.79,;29.04,-25.55,;27.72,-24.76,;28.95,-31.7,;30.19,-32.63,;29.69,-34.09,;28.14,-34.06,;27.1,-35.18,;27.55,-36.65,;25.61,-34.84,;25.15,-33.36,;26.21,-32.24,;27.7,-32.59,)| Show InChI InChI=1S/C23H21N7O/c1-13-7-4-5-10-17(13)30-21(28-16-9-6-8-14(2)18(16)23(30)31)15(3)29-12-27-19-20(24)25-11-26-22(19)29/h4-12,15H,1-3H3,(H2,24,25,26)/t15-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta in human PBMC assessed as reduction in anti-human CD28 antibody stimulated IL-6 secretion levels after 72 hrs by ELISA |
J Med Chem 60: 4304-4315 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00247
BindingDB Entry DOI: 10.7270/Q2V40XBD |
More data for this
Ligand-Target Pair | |
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