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BDBM348234 US9790228, Compound 153

SMILES: Nc1nc2cc(ccc2[nH]1)-c1nn(Cc2cc3ccccc3nc2N2CCCC2)c2ncnc(N)c12

InChI Key: InChIKey=LNIMNUHCJKWGJA-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 = 348234   
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 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM348234
PNG
(US9790228, Compound 153)
Show SMILES Nc1nc2cc(ccc2[nH]1)-c1nn(Cc2cc3ccccc3nc2N2CCCC2)c2ncnc(N)c12
Show InChI InChI=1S/C26H24N10/c27-23-21-22(16-7-8-19-20(12-16)33-26(28)32-19)34-36(25(21)30-14-29-23)13-17-11-15-5-1-2-6-18(15)31-24(17)35-9-3-4-10-35/h1-2,5-8,11-12,14H,3-4,9-10,13H2,(H2,27,29,30)(H3,28,32,33)
PDB
MMDB

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PC sid
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US Patent
n/an/a<100n/an/an/an/an/an/a



Intellikine LLC

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9790228 (2017)


BindingDB Entry DOI: 10.7270/Q26112FV
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit beta


(Homo sapiens (Human))
BDBM348234
PNG
(US9790228, Compound 153)
Show SMILES Nc1nc2cc(ccc2[nH]1)-c1nn(Cc2cc3ccccc3nc2N2CCCC2)c2ncnc(N)c12
Show InChI InChI=1S/C26H24N10/c27-23-21-22(16-7-8-19-20(12-16)33-26(28)32-19)34-36(25(21)30-14-29-23)13-17-11-15-5-1-2-6-18(15)31-24(17)35-9-3-4-10-35/h1-2,5-8,11-12,14H,3-4,9-10,13H2,(H2,27,29,30)(H3,28,32,33)
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antibodypedia
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PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Intellikine LLC

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9790228 (2017)


BindingDB Entry DOI: 10.7270/Q26112FV
More data for this
Ligand-Target Pair
PI3-kinase class I


(Homo sapiens (Human))
BDBM348234
PNG
(US9790228, Compound 153)
Show SMILES Nc1nc2cc(ccc2[nH]1)-c1nn(Cc2cc3ccccc3nc2N2CCCC2)c2ncnc(N)c12
Show InChI InChI=1S/C26H24N10/c27-23-21-22(16-7-8-19-20(12-16)33-26(28)32-19)34-36(25(21)30-14-29-23)13-17-11-15-5-1-2-6-18(15)31-24(17)35-9-3-4-10-35/h1-2,5-8,11-12,14H,3-4,9-10,13H2,(H2,27,29,30)(H3,28,32,33)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



Intellikine LLC

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9790228 (2017)


BindingDB Entry DOI: 10.7270/Q26112FV
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM348234
PNG
(US9790228, Compound 153)
Show SMILES Nc1nc2cc(ccc2[nH]1)-c1nn(Cc2cc3ccccc3nc2N2CCCC2)c2ncnc(N)c12
Show InChI InChI=1S/C26H24N10/c27-23-21-22(16-7-8-19-20(12-16)33-26(28)32-19)34-36(25(21)30-14-29-23)13-17-11-15-5-1-2-6-18(15)31-24(17)35-9-3-4-10-35/h1-2,5-8,11-12,14H,3-4,9-10,13H2,(H2,27,29,30)(H3,28,32,33)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



Intellikine LLC

US Patent


Assay Description
Class I PI3-Ks can be either purchased (p110α/p85α, p110β/p85α, p110δ/p85α from Upstate, and p110γ from Sigma) or ...


US Patent US9790228 (2017)


BindingDB Entry DOI: 10.7270/Q26112FV
More data for this
Ligand-Target Pair