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BDBM141161 US9682141, 524

SMILES: COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncn(C3CCN(C)CC3)c(=O)c2c1

InChI Key: InChIKey=VOMWDPNVILTEIO-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 141161   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Phosphatidylinositol 3-kinase regulatory subunit alpha


(Homo sapiens (Human))
BDBM141161
PNG
(US9682141, 524)
Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncn(C3CCN(C)CC3)c(=O)c2c1
Show InChI InChI=1S/C26H27N5O4S/c1-30-12-10-20(11-13-30)31-17-28-23-9-8-18(14-22(23)26(31)32)19-15-24(25(35-2)27-16-19)29-36(33,34)21-6-4-3-5-7-21/h3-9,14-17,20,29H,10-13H2,1-2H3
PDB

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PC sid
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n/an/a<100n/an/an/an/an/a25



Intellikine LLC

US Patent


Assay Description
Briefly, the assay is a time resolved FRET assay that indirectly measures PIP3 product formed by the activity of a PI3-K. The kinase reaction is perf...


US Patent US9682141 (2017)


BindingDB Entry DOI: 10.7270/Q2GF0RPH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM141161
PNG
(US9682141, 524)
Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncn(C3CCN(C)CC3)c(=O)c2c1
Show InChI InChI=1S/C26H27N5O4S/c1-30-12-10-20(11-13-30)31-17-28-23-9-8-18(14-22(23)26(31)32)19-15-24(25(35-2)27-16-19)29-36(33,34)21-6-4-3-5-7-21/h3-9,14-17,20,29H,10-13H2,1-2H3
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PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+3n/an/an/an/an/a25



Intellikine LLC

US Patent


Assay Description
Briefly, the assay is a time resolved FRET assay that indirectly measures PIP3 product formed by the activity of a PI3-K. The kinase reaction is perf...


US Patent US9682141 (2017)


BindingDB Entry DOI: 10.7270/Q2GF0RPH
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform


(Homo sapiens (Human))
BDBM141161
PNG
(US9682141, 524)
Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncn(C3CCN(C)CC3)c(=O)c2c1
Show InChI InChI=1S/C26H27N5O4S/c1-30-12-10-20(11-13-30)31-17-28-23-9-8-18(14-22(23)26(31)32)19-15-24(25(35-2)27-16-19)29-36(33,34)21-6-4-3-5-7-21/h3-9,14-17,20,29H,10-13H2,1-2H3
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PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/a25



Intellikine LLC

US Patent


Assay Description
Briefly, the assay is a time resolved FRET assay that indirectly measures PIP3 product formed by the activity of a PI3-K. The kinase reaction is perf...


US Patent US9682141 (2017)


BindingDB Entry DOI: 10.7270/Q2GF0RPH
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit beta


(Homo sapiens (Human))
BDBM141161
PNG
(US9682141, 524)
Show SMILES COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncn(C3CCN(C)CC3)c(=O)c2c1
Show InChI InChI=1S/C26H27N5O4S/c1-30-12-10-20(11-13-30)31-17-28-23-9-8-18(14-22(23)26(31)32)19-15-24(25(35-2)27-16-19)29-36(33,34)21-6-4-3-5-7-21/h3-9,14-17,20,29H,10-13H2,1-2H3
PDB
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KEGG

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antibodypedia
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PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/a25



Intellikine LLC

US Patent


Assay Description
Briefly, the assay is a time resolved FRET assay that indirectly measures PIP3 product formed by the activity of a PI3-K. The kinase reaction is perf...


US Patent US9682141 (2017)


BindingDB Entry DOI: 10.7270/Q2GF0RPH
More data for this
Ligand-Target Pair