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Target
Phosphatidylinositol 4-kinase beta
Ligand
BDBM513392
Substrate
n/a
Meas. Tech.
Kinase Activity Assay
IC50
<1000±n/a nM
Citation
 Glenn, JS; Gelman, MA; Tavshanjian, B; Shokat, K; Choong, I; Smith, M PI-kinase inhibitors with anti-infective activity US Patent  US11091472 Publication Date 8/17/2021 
Target
Name:
Phosphatidylinositol 4-kinase beta
Synonyms:
NPIK | PI4-kinase beta subunit | PI4K-beta | PI4K92 | PI4KB | PI4KB_HUMAN | PI4Kbeta | PIK4B | PIK4CB | Phosphatidylinositol 4-kinase beta | Phosphatidylinositol 4-kinase, PI4K | PtdIns 4-kinase beta
Type:
Protein
Mol. Mass.:
91373.30
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
816
Sequence:
MGDTVVEPAPLKPTSEPTSGPPGNNGGSLLSVITEGVGELSVIDPEVAQKACQEVLEKVKLLHGGVAVSSRGTPLELVNGDGVDSEIRCLDDPPAQIREEEDEMGAAVASGTAKGARRRRQNNSAKQSWLLRLFESKLFDISMAISYLYNSKEPGVQAYIGNRLFCFRNEDVDFYLPQLLNMYIHMDEDVGDAIKPYIVHRCRQSINFSLQCALLLGAYSSDMHISTQRHSRGTKLRKLILSDELKPAHRKRELPSLSPAPDTGLSPSKRTHQRSKSDATASISLSSNLKRTASNPKVENEDEELSSSTESIDNSFSSPVRLAPEREFIKSLMAIGKRLATLPTKEQKTQRLISELSLLNHKLPARVWLPTAGFDHHVVRVPHTQAVVLNSKDKAPYLIYVEVLECENFDTTSVPARIPENRIRSTRSVENLPECGITHEQRAGSFSTVPNYDNDDEAWSVDDIGELQVELPEVHTNSCDNISQFSVDSITSQESKEPVFIAAGDIRRRLSEQLAHTPTAFKRDPEDPSAVALKEPWQEKVRRIREGSPYGHLPNWRLLSVIVKCGDDLRQELLAFQVLKQLQSIWEQERVPLWIKPYKILVISADSGMIEPVVNAVSIHQVKKQSQLSLLDYFLQEHGSYTTEAFLSAQRNFVQSCAGYCLVCYLLQVKDRHNGNILLDAEGHIIHIDFGFILSSSPRNLGFETSAFKLTTEFVDVMGGLDGDMFNYYKMLMLQGLIAARKHMDKVVQIVEIMQQGSQLPCFHGSSTIRNLKERFHMSMTEEQLQLLVEQMVDGSMRSITTKLYDGFQYLTNGIM
  
Inhibitor
Name:
BDBM513392
Synonyms:
US11091472, Compound S-166
Type:
Small organic molecule
Emp. Form.:
C23H33N3O4S2
Mol. Mass.:
479.656
SMILES:
COc1ccc(cc1S(=O)(=O)N[C@H]1CC[C@H](O)CC1)-c1sc(NC2CCCCC2)nc1C |r,wU:12.12,wD:15.16,(-7.66,-.74,;-6.48,-1.73,;-5.15,-.96,;-5.15,.58,;-3.82,1.35,;-2.48,.58,;-2.48,-.96,;-3.82,-1.73,;-3.82,-3.27,;-5.36,-3.27,;-4.22,-4.76,;-2.48,-4.04,;-.94,-4.04,;-.17,-2.71,;1.37,-2.71,;2.14,-4.04,;3.68,-4.04,;1.37,-5.37,;-.17,-5.37,;-1.15,1.35,;.26,.72,;1.29,1.87,;2.82,1.71,;3.91,2.8,;5.4,2.4,;6.48,3.49,;6.09,4.97,;4.6,5.37,;3.51,4.28,;.52,3.2,;-.99,2.88,;-2.13,3.91,)|
Structure:
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