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Target
Mitogen-activated protein kinase kinase kinase kinase 1
Ligand
BDBM598134
Substrate
n/a
Meas. Tech.
TBD
Ki
<0.013±n/a nM
Citation
 Liang, J; Mendonca, RV; Siu, M; Tellis, J; Wang, W; Wei, B; Chan, B; Choo, EF; Drobnick, J; Gazzard, LJ; Heffron, T 8-aminoisoquinoline compounds and uses thereof US Patent  US11612606 Publication Date 3/28/2023
Target
Name:
Mitogen-activated protein kinase kinase kinase kinase 1
Synonyms:
HPK1 | M4K1_HUMAN | MAP4K1
Type:
PROTEIN
Mol. Mass.:
91316.07
Organism:
Homo sapiens (Human)
Description:
ChEMBL_586597
Residue:
833
Sequence:
MDVVDPDIFNRDPRDHYDLLQRLGGGTYGEVFKARDKVSGDLVALKMVKMEPDDDVSTLQKEILILKTCRHANIVAYHGSYLWLQKLWICMEFCGAGSLQDIYQVTGSLSELQISYVCREVLQGLAYLHSQKKIHRDIKGANILINDAGEVRLADFGISAQIGATLARRLSFIGTPYWMAPEVAAVALKGGYNELCDIWSLGITAIELAELQPPLFDVHPLRVLFLMTKSGYQPPRLKEKGKWSAAFHNFIKVTLTKSPKKRPSATKMLSHQLVSQPGLNRGLILDLLDKLKNPGKGPSIGDIEDEEPELPPAIPRRIRSTHRSSSLGIPDADCCRRHMEFRKLRGMETRPPANTARLQPPRDLRSSSPRKQLSESSDDDYDDVDIPTPAEDTPPPLPPKPKFRSPSDEGPGSMGDDGQLSPGVLVRCASGPPPNSPRPGPPPSTSSPHLTAHSEPSLWNPPSRELDKPPLLPPKKEKMKRKGCALLVKLFNGCPLRIHSTAAWTHPSTKDQHLLLGAEEGIFILNRNDQEATLEMLFPSRTTWVYSINNVLMSLSGKTPHLYSHSILGLLERKETRAGNPIAHISPHRLLARKNMVSTKIQDTKGCRACCVAEGASSGGPFLCGALETSVVLLQWYQPMNKFLLVRQVLFPLPTPLSVFALLTGPGSELPAVCIGVSPGRPGKSVLFHTVRFGALSCWLGEMSTEHRGPVQVTQVEEDMVMVLMDGSVKLVTPEGSPVRGLRTPEIPMTEAVEAVAMVGGQLQAFWKHGVQVWALGSDQLLQELRDPTLTFRLLGSPRLECSGTISPHCNLLLPGSSNSPASASRVAGITGL
  
Inhibitor
Name:
BDBM598134
Synonyms:
3-Hydroxy-3-methylcyclobutyl(8-amino- 7-fluoro-6-(8-methyl-2,3-dihydro-1H- pyrido[2,3-b][1,4]oxazin-7- yl)isoquinolin-3-yl)carbamate | US11612606, Compound 486
Type:
Small organic molecule
Emp. Form.:
C23H24FN5O4
Mol. Mass.:
453.4662
SMILES:
Cc1c2NCCOc2ncc1-c1cc2cc(NC(=O)OC3CC(C)(O)C3)ncc2c(N)c1F |(2.55,-2.09,;3.88,-1.32,;5.21,-2.09,;5.21,-3.63,;6.55,-4.4,;7.88,-3.63,;7.88,-2.09,;6.55,-1.32,;6.55,.22,;5.21,.99,;3.88,.22,;2.55,.99,;1.21,.22,;-.12,.99,;-1.46,.22,;-2.79,.99,;-4.12,.22,;-5.46,.99,;-5.46,2.53,;-6.79,.22,;-6.79,-1.32,;-7.88,-2.41,;-6.79,-3.5,;-7.56,-4.84,;-6.02,-4.84,;-5.7,-2.41,;-2.79,2.53,;-1.46,3.3,;-.12,2.53,;1.21,3.3,;1.21,4.84,;2.55,2.53,;3.88,3.3,)|
Structure:
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