Ki Summary new BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetTestis-specific serine/threonine-protein kinase 1
LigandBDBM50436850
Substrate/Competitorn/a
Meas. Tech.ChEMBL_971443
IC50 23±n/a nM
Citation Marsilje THPei WChen BLu WUno TJin YJiang TKim SLi NWarmuth MSarkisova YSun FSteffy APferdekamper ACLi AGJoseph SBKim YLiu BTuntland TCui XGray NSSteensma RWan YJiang JChopiuk GLi JGordon WPRichmond WJohnson KChang JGroessl THe YQPhimister AAycinena ALee CCBursulaya BKaranewsky DSSeidel HMHarris JLMichellys PY Synthesis, structure-activity relationships, and in vivo efficacy of the novel potent and selective anaplastic lymphoma kinase (ALK) inhibitor 5-chloro-N2-(2-isopropoxy-5-methyl-4-(piperidin-4-yl)phenyl)-N4-(2-(isopropylsulfonyl)phenyl)pyrimidine-2,4-diamine (LDK378) currently in phase 1 and phase  J Med Chem 56:5675-90 (2014) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Testis-specific serine/threonine-protein kinase 1
Name:Testis-specific serine/threonine-protein kinase 1
Synonyms:TSSK1 | Testis-specific serine/threonine-protein kinase 1
Type:Enzyme Catalytic Domain
Mol. Mass.:41624.03
Organism:Homo sapiens (Human)
Description:gi_14042947
Residue:367
Sequence:
MDDAAVLKRRGYLLGINLGEGSYAKVKSAYSERLKFNVAIKIIDRKKAPADFLEKFLPRE
IEILAMLNHCSIIKTYEIFETSHGKVYIVMELAVQGDLLELIKTRGALHEDEARKKFHQL
SLAIKYCHDLDVVHRDLKCDNLLLDKDFNIKLSDFSFSKRCLRDDSGRMALSKTFCGSPA
YAAPEVLQGIPYQPKVYDIWSLGVILYIMVCGSMPYDDSNIKKMLRIQKEHRVNFPRSKH
LTGECKDLIYHMLQPDVNRRLHIDEILSHCWMQPKARGSPSVAINKEGESSRGTEPLWTP
EPGSDKKSATKLEPEGEAQPQAQPETKPEGTAMQMSRQSEILGFPSKPSTMETEEGPPQQ
PPETRAQ
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50436850
n/a
NameBDBM50436850
Synonyms:CERITINIB | CHEMBL2403108 | LDK378 | US10053458, Comparative Example 2 | US9809572, Example 16
TypeSmall organic molecule
Emp. Form.C28H36ClN5O3S
Mol. Mass.558.135
SMILESCC(C)Oc1cc(C2CCNCC2)c(C)cc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: