Reaction Details Report a problem with these data
Target
Proto-oncogene tyrosine-protein kinase Src
Ligand
BDBM81725
Substrate
n/a
Meas. Tech.
Kinase Assay
IC50
73±0.0 nM
Citation
Shakespeare, WC; Wang, Y; Bohacek, R; Keenan, T; Sundaramoorthi, R; Metcalf, C; Dilauro, A; Roeloffzen, S; Liu, S; Saltmarsh, J; Paramanathan, G; Dalgarno, D; Narula, S; Pradeepan, S; van Schravendijk, MR; Keats, J; Ram, M; Liou, S; Adams, S; Wardwell, S; Bogus, J; Iuliucci, J; Weigele, M; Xing, L; Boyce, B; Sawyer, TK SAR of carbon-linked, 2-substituted purines: synthesis and characterization of AP23451 as a novel bone-targeted inhibitor of Src tyrosine kinase with in vivo anti-resorptive activity. Chem Biol Drug Des 71:97-105 (2008) [PubMed] Article
More Info.:
Target
Name:
Proto-oncogene tyrosine-protein kinase Src
Synonyms:
Neuronal proto-oncogene tyrosine-protein kinase Src | Proto-oncogene c-Src | SRC_MOUSE | Src | Tyrosine-protein kinase SRC
Type:
Protein
Mol. Mass.:
60650.57
Organism:
Mus musculus (Mouse)
Description:
P05480
Residue:
541
Sequence:
MGSNKSKPKDASQRRRSLEPSENVHGAGGAFPASQTPSKPASADGHRGPSAAFVPPAAEPKLFGGFNSSDTVTSPQRAGPLAGGVTTFVALYDYESRTETDLSFKKGERLQIVNNTRKVDVREGDWWLAHSLSTGQTGYIPSNYVAPSDSIQAEEWYFGKITRRESERLLLNAENPRGTFLVRESETTKGAYCLSVSDFDNAKGLNVKHYKIRKLDSGGFYITSRTQFNSLQQLVAYYSKHADGLCHRLTTVCPTSKPQTQGLAKDAWEIPRESLRLEVKLGQGCFGEVWMGTWNGTTRVAIKTLKPGTMSPEAFLQEAQVMKKLRHEKLVQLYAVVSEEPIYIVTEYMNKGSLLDFLKGETGKYLRLPQLVDMSAQIASGMAYVERMNYVHRDLRAANILVGENLVCKVADFGLARLIEDNEYTARQGAKFPIKWTAPEAALYGRFTIKSDVWSFGILLTELTTKGRVPYPGMVNREVLDQVERGYRMPCPPECPESLHDLMCQCWRKEPEERPTFEYLQAFLEDYFTSTEPQYQPGENL
Inhibitor
Name:
BDBM81725
Synonyms:
2,6,9-Trisubstituted Purine, AP23517
Type:
Small organic molecule
Emp. Form.:
C19H24N6
Mol. Mass.:
336.4341
SMILES:
CCn1cnc2c(Nc3ccccc3)nc(nc12)[C@H]1CC[C@H](N)CC1 |r,wU:18.20,wD:21.24,(-4.33,-3.25,;-3.3,-2.11,;-3.77,-.64,;-2.87,.6,;-3.77,1.85,;-5.24,1.37,;-6.57,2.14,;-6.57,3.68,;-5.24,4.45,;-5.24,5.99,;-3.91,6.76,;-2.57,5.99,;-2.57,4.45,;-3.91,3.68,;-7.91,1.37,;-7.91,-.17,;-6.57,-.94,;-5.24,-.17,;-9.24,-.94,;-9.24,-2.48,;-10.57,-3.25,;-11.91,-2.48,;-13.24,-3.25,;-11.91,-.94,;-10.57,-.17,)|