Foretinib - Small Molecule (ID:10157-101)

HMS LINCS ID: 10157-101
Name: Foretinib
Alternative Names: XL880; GSK1363089
LINCS ID: LSM-1158
PubChem CID: 42642645
ChEBI ID:
ChEMBL ID:
Molecular Mass: 632.24
InChi: InChI=1S/C34H34F2N4O6/c1-43-30-20-25-27(21-31(30)45-16-2-13-40-14-17-44-18-15-40)37-12-9-28(25)46-29-8-7-24(19-26(29)36)39-33(42)34(10-11-34)32(41)38-23-5-3-22(35)4-6-23/h3-9,12,19-21H,2,10-11,13-18H2,1H3,(H,38,41)(H,39,42)
InChi Key: CXQHYVUVSFXTMY-UHFFFAOYSA-N
SMILES: COC1=CC2=C(C=CN=C2C=C1OCCCN3CCOCC3)OC4=C(C=C(C=C4)NC(=O)C5(CC5)C(=O)NC6=CC=C(C=C6)F)F
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update: 2016-04-04

Target Affinity:

(see Study 20000)
Target Affinity Spectrum Value HUGO Gene Name
1
(Kd <100 nM)
ABL1, ABL2, AIM1, ALK, AURKB, AURKC, AXL, BLK, BTK, CDK14, CDK15, CDK19, CDK7, CHEK2, CSF1R, DDR1, DDR2, EPHA1, EPHA2, EPHA3, EPHA4, EPHA5, EPHA6, EPHA7, EPHA8, EPHB1, EPHB2, EPHB3, EPHB4, EPHB6, FER, FGR, FLT1, FLT3, FLT4, FRK, FYN, HCK, HIPK3, HIPK4, INSRR, ITK, KDR, KIT, LCK, LYN, MAP2K1, MAP2K2, MAP2K5, MAP3K12, MAP3K13, MAP3K19, MAP3K20, MAP4K1, MAP4K5, MAPK13, MAPK15, MERTK, MET, MKNK1, MKNK2, MST1R, MUSK, NTRK1, NTRK2, NTRK3, PDGFRA, PDGFRB, PIP4K2C, PLK4, PTK2B, PTK6, RET, RIPK2, ROS1, SLK, SRC, SRMS, STK10, STK33, TEK, TIE1, TKT, TNK1, TYRO3, YES1
2
(equivalent to 100 nM ≤ Kd < 1µM)
AURKA, BMX, CAMKK1, CDC42BPA, CDC42BPB, CDC42BPG, CDK11A, CDK11B, CDK13, CDK16, CDK17, CDK18, CDK8, CDKL2, CLK1, CLK4, CSK, DSTYK, EGFR, EIF2AK1, ERBB2, ERBB4, FES, FGFR1, FGFR2, FLG, FPGT-TNNI3K, HIPK1, HIPK2, IGF1R, INSR, IRAK3, LIMK1, LTK, MAP3K10, MAP3K11, MAP3K7, MAP4K3, MAP4K4, MAPK11, MAPK12, MAPK14, MAPK9, MELK, MYO3B, NEK8, NEK9, NLK, PF3D7_0217500, PRKAA1, PTK2, RIPK1, RIPK4, SIK1, SIK1B, SIK2, STK35, STK36, SYK, TBK1, TEC, TESK1, TNIK, TNK2, TNNI3K, TTK, TXK, ULK3
3
(equivalent to 1µM ≤ Kd < 10 µM)
ANKK1, BRAF, CAMK1, CAMK1D, CAMKK2, CDK9, CDKL3, CDKL5, CHUK, CIT, CSNK1E, CSNK2A2, DAPK3, DYRK2, ERBB3, FGFR3, HUNK, IKBKE, JAK2, LIMK2, MAK, MAP3K2, MAP3K3, MAP3K4, MAP3K9, MAP4K2, MAPK10, MAPK8, MINK1, MST1, MYLK2, MYLK3, MYO3A, PAK3, PRKAA2, PRKD3, RAF1, ROCK2, RPS6KA2, RPS6KB1, STK25, STK4, TAOK1, TAOK2, TPTEP2-CSNK1E, TYK2
10
(confirmed non-binding)
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Batch Information for HMSL10157-101-2:

HMS LINCS Batch ID: 10157-101-2
Provider: Haoyuan chemexpress
Provider Batch ID: HY-10338-20111209
Salt: 101
Molecular Formula: C34H34F2N4O6
Molecular Weight: 632.65
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2013-05-06
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10157-101-2:

Date HMS QC Outcome Comment Files
04/13/2015 PASS HMSL10157-101-2_LCMS.pdf