Bosutinib - Small Molecule (ID:10189-999)

HMS LINCS ID: 10189-999
Name: Bosutinib
Alternative Names: SKI-606
LINCS ID: LSM-1190
PubChem CID: 5328940
ChEBI ID:
ChEMBL ID:
Molecular Mass: 529.16
InChi: InChI=1S/C26H29Cl2N5O3/c1-32-6-8-33(9-7-32)5-4-10-36-25-13-21-18(11-24(25)35-3)26(17(15-29)16-30-21)31-22-14-23(34-2)20(28)12-19(22)27/h11-14,16H,4-10H2,1-3H3,(H,30,31)
InChi Key: UBPYILGKFZZVDX-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CC(=C3NC4=CC(=C(C=C4Cl)Cl)OC)C#N)OC
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update: 2016-07-12

Target Affinity:

(see Study 20000)
Target Affinity Spectrum Value HUGO Gene Name
1
(Kd <100 nM)
ABL1, ABL2, AXL, BCR, Blk, BLK, BTK, CSK, DMPK, EGFR, EPHA2, EPHA3, EPHA4, EPHA5, EPHA8, EPHB1, EPHB2, EPHB4, ERBB3, ERBB4, FGR, FRK, FYN, GAK, HCK, IKBKE, LCK, LYN, MAP2K1, MAP2K2, MAP2K5, MAP3K19, MAP3K2, MAP3K20, MAP3K3, MAP4K1, MAP4K2, MAP4K3, MAP4K4, MAP4K5, MINK1, SIK1, SIK1B, SIK2, SIK3, SLK, SRC, STK10, STK26, STK33, STK35, TNIK, TNK2, TXK, TYRO3, WEE2, YES1
2
(equivalent to 100 nM ≤ Kd < 1µM)
ALK, BMP2K, BMPR2, BMX, CAMK1D, CAMKK2, CASK, CHEK2, CLK1, CLK3, CSF1R, CSNK1A1, CSNK1D, CSNK1E, DDR1, DDR2, DSTYK, EIF2AK1, EIF2AK4, EPHB3, FER, FES, FPGT-TNNI3K, HIPK1, HIPK4, IRAK1, IRAK4, KIT, LRRK2, MAP3K12, MAP3K13, MAP3K4, MAP3K7, MAST1, MERTK, MST1, MYLK, MYT1, NEK11, NEK2, NTRK2, NUAK2, PDGFRB, PHKG1, PKMYT1, PLK2, PRKCQ, PTK2, PTK2B, ROCK1, ROCK2, RPS6KB1, SRMS, STK24, STK25, STK3, STK36, STK4, SYK, TAOK3, TBK1, TKT, TLK1, TNNI3K, TPTEP2-CSNK1E, ULK2, ULK3, VRK2, WEE1
3
(equivalent to 1µM ≤ Kd < 10 µM)
AAK1, ANKK1, CAMK2A, CAMK2G, CDK14, CDK15, CDK16, CDK7, CHEK1, CIT, CLK2, CLK4, CSNK1A1L, DCLK3, EPHA1, EPHA6, EPHB6, ERBB2, FLT3, GRK4, GRK7, HIPK2, HIPK3, HUNK, ITK, JAK2, JAK3, LTK, MAP2K3, MAP2K4, MAP2K6, MAP2K7, MAP3K1, MAP3K11, MAP3K9, MAPK7, MATK, MET, MST1R, MYO3A, MYO3B, NIM1K, NLK, NTRK1, NTRK3, NUAK1, PAK1, PAK2, PAK3, PDGFRA, PHKG2, PIP5K1A, PKN1, PKN2, pknB, PLK1, PRKAA1, PRKCD, PRKCE, PRKD3, RET, RIOK1, RIOK3, RIPK2, RPS6KA2, RPS6KA3, RPS6KA6, SRPK3, STK32A, STK39, TAOK1, TAOK2, TEC, TEK, TIE1, TLK2, TSSK1B, TYK2, ULK1, ZAP70
10
(confirmed non-binding)
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Datasets:

HMS Dataset ID Dataset Title HMS Dataset Type
20000
Target Affinity Spectrum (TAS) vectors for compounds in the HMS LINCS small molecule library.
Analysis
20184
SKI-606 KINOMEscan
 KINOMEscan

Batch Information:

HMS LINCS Batch ID Provider Provider Batch ID
10189-999-4