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Target
Mitogen-activated protein kinase kinase kinase 12
Ligand
BDBM301613
Substrate
n/a
Meas. Tech.
DLK TR-FRET Inhibition Assay
Ki
866±n/a nM
Citation
 Estrada, A; Patel, S; Kellar, T; Huestis, M; Shore, D; Siu, M Tricyclic DLK inhibitors and uses thereof US Patent  US10131675 Publication Date 11/20/2018 
Target
Name:
Mitogen-activated protein kinase kinase kinase 12
Synonyms:
DLK | Dual leucine zipper bearing kinase | Leucine-zipper protein kinase | M3K12_HUMAN | MAP3K12 | MAPK-upstream kinase | MUK | Mitogen-activated protein kinase kinase kinase 12 | Mixed lineage kinase | ZPK
Type:
PROTEIN
Mol. Mass.:
93216.56
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1460553
Residue:
859
Sequence:
MACLHETRTPSPSFGGFVSTLSEASMRKLDPDTSDCTPEKDLTPTHVLQLHEQDAGGPGGAAGSPESRASRVRADEVRLQCQSGSGFLEGLFGCLRPVWTMIGKAYSTEHKQQQEDLWEVPFEEILDLQWVGSGAQGAVFLGRFHGEEVAVKKVRDLKETDIKHLRKLKHPNIITFKGVCTQAPCYCILMEFCAQGQLYEVLRAGRPVTPSLLVDWSMGIAGGMNYLHLHKIIHRDLKSPNMLITYDDVVKISDFGTSKELSDKSTKMSFAGTVAWMAPEVIRNEPVSEKVDIWSFGVVLWELLTGEIPYKDVDSSAIIWGVGSNSLHLPVPSSCPDGFKILLRQCWNSKPRNRPSFRQILLHLDIASADVLSTPQETYFKSQAEWREEVKLHFEKIKSEGTCLHRLEEELVMRRREELRHALDIREHYERKLERANNLYMELNALMLQLELKERELLRREQALERRCPGLLKPHPSRGLLHGNTMEKLIKKRNVPQKLSPHSKRPDILKTESLLPKLDAALSGVGLPGCPKGPPSPGRSRRGKTRHRKASAKGSCGDLPGLRTAVPPHEPGGPGSPGGLGGGPSAWEACPPALRGLHHDLLLRKMSSSSPDLLSAALGSRGRGATGGAGDPGSPPPARGDTPPSEGSAPGSTSPDSPGGAKGEPPPPVGPGEGVGLLGTGREGTSGRGGSRAGSQHLTPAALLYRAAVTRSQKRGISSEEEEGEVDSEVELTSSQRWPQSLNMRQSLSTFSSENPSDGEEGTASEPSPSGTPEVGSTNTDERPDERSDDMCSQGSEIPLDPPPSEVIPGPEPSSLPIPHQELLRERGPPNSEDSDCDSTELDNSNSVDALRPPASLPP
  
Inhibitor
Name:
BDBM301613
Synonyms:
US10131675, Example 99
Type:
Small organic molecule
Emp. Form.:
C18H17F3N8O
Mol. Mass.:
418.3758
SMILES:
Nc1ncc(cn1)-c1nc(N2CC3CC2C3)c2nc3[C@H](OCCn3c2n1)C(F)(F)F |r,wU:19.31,(-.06,7.41,;-.06,5.87,;1.27,5.1,;1.27,3.56,;-.06,2.79,;-1.39,3.56,;-1.39,5.1,;-.06,1.25,;1.27,.48,;1.27,-1.06,;2.61,-1.83,;4.07,-1.35,;4.98,-2.6,;4.07,-3.85,;2.61,-3.37,;3.57,-2.59,;-.06,-1.83,;-.38,-3.34,;-1.91,-3.5,;-2.82,-4.74,;-4.35,-4.58,;-4.98,-3.18,;-4.07,-1.93,;-2.54,-2.09,;-1.39,-1.06,;-1.39,.48,;-2.05,-6.08,;-2.82,-7.41,;-.51,-6.08,;-1.28,-7.41,)|
Structure:
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