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Target
Cyclin-T1/Cyclin-dependent kinase 9 [L156F]
Ligand
BDBM50553483
Substrate
n/a
Meas. Tech.
Enzyme Activity Assay of CDK9 Protein Inhibition In Vitro
IC50
1252±n/a nM
Citation
 LIU, Q; LIU, J; WU, Y; WANG, B; WANG, A; HU, C; LIU, Q; ZOU, F; WANG, W; WANG, Z; CAO, J; SHI, C; WANG, L DIHYDROISOQUINOLINONE AND ISOINDOLINONE DERIVATIVES AND USES THEREOF US Patent  US20230416221 Publication Date 12/28/2023 
Target
Name:
Cyclin-T1/Cyclin-dependent kinase 9 [L156F]
Synonyms:
n/a
Type:
Protein
Mol. Mass.:
n/a
Description:
n/a
Components:
This complex has 2 components.
Component 1
Name:
Cyclin-dependent kinase 9 [L156F]
Synonyms:
Cyclin-dependent kinase 9 (L156F)
Type:
Protein
Mol. Mass.:
42823.15
Organism:
Human
Description:
P50750[L156F]
Residue:
372
Sequence:
MAKQYDSVECPFCDEVSKYEKLAKIGQGTFGEVFKARHRKTGQKVALKKVLMENEKEGFPITALREIKILQLLKHENVVNLIEICRTKASPYNRCKGSIYLVFDFCEHDLAGLLSNVLVKFTLSEIKRVMQMLLNGLYYIHRNKILHRDMKAANVFITRDGVLKLADFGLARAFSLAKNSQPNRYTNRVVTLWYRPPELLLGERDYGPPIDLWGAGCIMAEMWTRSPIMQGNTEQHQLALISQLCGSITPEVWPNVDNYELYEKLELVKGQKRKVKDRLKAYVRDPYALDLIDKLLVLDPAQRIDSDDALNHDFFWSDPMPSDLKGMLSTHLTSMFEYLAPPRRKGSQITQQSTNQSRNPATTNQTEFERVF
  
Component 2
Name:
Cyclin-T1
Synonyms:
CycT | CycT1 | Cyclin T | Cyclin T1 | Cyclin-T | CCNT1_HUMAN | CCNT1
Type:
Enzyme Subunit
Mol. Mass.:
80712.40
Organism:
Human
Description:
n/a
Residue:
726
Sequence:
MEGERKNNNKRWYFTREQLENSPSRRFGVDPDKELSYRQQAANLLQDMGQRLNVSQLTINTAIVYMHRFYMIQSFTQFPGNSVAPAALFLAAKVEEQPKKLEHVIKVAHTCLHPQESLPDTRSEAYLQQVQDLVILESIILQTLGFELTIDHPHTHVVKCTQLVRASKDLAQTSYFMATNSLHLTTFSLQYTPPVVACVCIHLACKWSNWEIPVSTDGKHWWEYVDATVTLELLDELTHEFLQILEKTPNRLKRIWNWRACEAAKKTKADDRGTDEKTSEQTILNMISQSSSDTTIAGLMSMSTSTTSAVPSLPVSEESSSNLTSVEMLPGKRWLSSQPSFKLEPTQGHRTSENLALTGVDHSLPQDGSNAFISQKQNSKSVPSAKVSLKEYRAKHAEELAAQKRQLENMEANVKSQYAYAAQNLLSHHDSHSSVILKMPIEGSENPERPFLEKADKTALKMRIPVAGGDKAASSKPEEIKMRIKVHAAADKHNSVEDSVTKSREHKEKHKTHPSNHHHHHNHHSHKHSHSQLPVGTGNKRPGDPKHSSQTSNLAHKTYSLSSSFSSSSSTRKRGPSEETGGAVFDHPAKIAKSTKSSSLNFSFPSLPTMGQMPGHSSDTSGLSFSQPSCKTRVPHSKLDKGPTGANGHNTTQTIDYQDTVNMLHSLLSAQGVQPTQPTAFEFVRPYSDYLNPRSGGISSRSGNTDKPRPPPLPSEPPPPLPPLPK
  
Inhibitor
Name:
BDBM50553483
Synonyms:
CHEMBL4756595 | US20230416221, Compound BAY1251152
Type:
Small organic molecule
Emp. Form.:
C19H18F2N4O2S
Mol. Mass.:
404.44
SMILES:
COc1cc(F)ccc1-c1cc(Nc2cc(CS(C)(=N)=O)ccn2)ncc1F
Structure:
Search PDB for entries with ligand similarity: