Linsitinib - Small Molecule (ID:10135-101)

HMS LINCS ID: 10135-101
Name: Linsitinib
Alternative Names: OSI 906
LINCS ID: LSM-1135
PubChem CID: 11640390
ChEBI ID:
ChEMBL ID: 1091644
Molecular Mass: 421.19
InChi: InChI=1S/C26H23N5O/c1-26(32)14-19(15-26)25-30-22(23-24(27)28-11-12-31(23)25)18-8-7-17-9-10-20(29-21(17)13-18)16-5-3-2-4-6-16/h2-13,19,32H,14-15H2,1H3,(H2,27,28)
InChi Key: PKCDDUHJAFVJJB-UHFFFAOYSA-N
SMILES: CC1(CC(C1)C2=NC(=C3N2C=CN=C3N)C4=CC5=C(C=C4)C=CC(=N5)C6=CC=CC=C6)O
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)
IGF1R, INSR
2
(equivalent to 100 nM ≤ Kd < 1µM)
ABL1, AIM1, AURKB, BLK, ERBB4, FLT1, FLT4, FYN, LCK, LYN, MAP4K2, MAP4K5, RET, ROCK1
3
(equivalent to 1µM ≤ Kd < 10 µM)
AKT1, AKT2, ALK, AURKA, BTK, CAMK1, CAMK2B, CAMK2D, CAMK2G, CDC42BPA, CDC7, CDK1, CDK2, CHEK1, CHEK2, CLK2, CSF1R, CSNK1A1, CSNK1D, CSNK1G1, CSNK1G2, CSNK1G3, CSNK2A1, DAPK3, DYRK1A, DYRK4, EGFR, EPHA2, ERBB2, FER, FES, FGFR1, FGFR3, FLG, FLT3, FRK, GSK3A, GSK3B, HIPK2, HIPK4, IRAK1, ITK, JAK2, JAK3, KDR, KIT, MAPK1, MAPK12, MAPK13, MAPK8, MAPK9, MAPKAPK2, MAPKAPK5, MARK2, MARK3, MATK, MELK, MET, NEK2, NEK4, NTRK1, NTRK2, NTRK3, PAK4, PDK1, PDPK1, PHKG2, PIM2, PIM3, PKN2, PLK1, PLK3, PLK4, PRKAA1, PRKACA, PRKCD, PRKCG, PRKCI, PRKCZ, PRKG1, PRKG2, PRKX, ROCK2, ROS1, RPS6KA3, RPS6KA5, RPS6KB1, SRC, SRMS, SRPK1, STK17A, STK3, SYK, TSSK1B, TSSK2, TYK2, TYRO3
10
(confirmed non-binding)
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Batch Information for HMSL10135-101-3:

HMS LINCS Batch ID: 10135-101-3
Provider: MedChem Express
Provider Batch ID: 09453
Salt: 101
Molecular Formula: C26H23N5O
Molecular Weight: 421.49
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2015-06-17
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10135-101-3:

Date HMS QC Outcome Comment Files
08/31/2015 PASS HMSL10135-101-3_NMR.pdf,
HMSL10135-101-3_LCMS.pdf