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BDBM120848 US9682141, 67

SMILES: CS(=C)(=O)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1

InChI Key: InChIKey=SDVINOXXIYUJET-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 120848   
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))
BDBM120848
PNG
(US9682141, 67)
Show SMILES CS(=C)(=O)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Show InChI InChI=1S/C22H23N5O3S/c1-31(2,29)26-9-7-16(8-10-26)27-13-24-18-5-3-14(11-17(18)21(27)28)15-4-6-20-19(12-15)25-22(23)30-20/h3-6,11-13,16H,1,7-10H2,2H3,(H2,23,25)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
Article
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)


Article DOI: 10.1021/jm960541s
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))
BDBM120848
PNG
(US9682141, 67)
Show SMILES CS(=C)(=O)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Show InChI InChI=1S/C22H23N5O3S/c1-31(2,29)26-9-7-16(8-10-26)27-13-24-18-5-3-14(11-17(18)21(27)28)15-4-6-20-19(12-15)25-22(23)30-20/h3-6,11-13,16H,1,7-10H2,2H3,(H2,23,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a>1.00E+4n/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)


Article DOI: 10.1021/jm960541s
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))
BDBM120848
PNG
(US9682141, 67)
Show SMILES CS(=C)(=O)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Show InChI InChI=1S/C22H23N5O3S/c1-31(2,29)26-9-7-16(8-10-26)27-13-24-18-5-3-14(11-17(18)21(27)28)15-4-6-20-19(12-15)25-22(23)30-20/h3-6,11-13,16H,1,7-10H2,2H3,(H2,23,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a>1.00E+4n/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)


Article DOI: 10.1021/jm960541s
BindingDB Entry DOI: 10.7270/Q2GF0RPH
More data for this
Ligand-Target Pair