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BDBM346210 US10202373, Compound I-23::US10202373, Example 3K

SMILES: CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)N1CCCC1

InChI Key: InChIKey=JXWJWFQUYTYJSQ-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 346210   
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 catalytic subunit type 3


(Homo sapiens (Human))
BDBM346210
PNG
(US10202373, Compound I-23 | US10202373, Example 3K)
Show SMILES CC(=O)Nc1cc(ccn1)-c1cnc(C)c2n(ccc12)S(=O)(=O)N1CCCC1
Show InChI InChI=1S/C19H21N5O3S/c1-13-19-16(6-10-24(19)28(26,27)23-8-3-4-9-23)17(12-21-13)15-5-7-20-18(11-15)22-14(2)25/h5-7,10-12H,3-4,8-9H2,1-2H3,(H,20,22,25)
PDB
MMDB

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KEGG

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PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



MILLENNIUM PHARMACEUTICALS, INC.

US Patent


Assay Description
100 nL compounds in DMSO are added to wells of a 384 well microtitre plate (Greiner 780076). At room temperature: 5 ul VPS34 reaction buffer (Invitro...


US Patent US10202373 (2019)

More data for this
Ligand-Target Pair