Sotrastaurin - Small Molecule (ID:10408-101)
| HMS LINCS ID: |
10408-101
|
| Name: | Sotrastaurin |
| Alternative Names: | AEB071 |
| LINCS ID: | |
| PubChem CID: | 10296883 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 438.18 |
| InChi: | InChI=1S/C25H22N6O2/c1-30-10-12-31(13-11-30)25-27-19-9-5-3-7-16(19)22(28-25)21-20(23(32)29-24(21)33)17-14-26-18-8-4-2-6-15(17)18/h2-9,14,26H,10-13H2,1H3,(H,29,32,33) |
| InChi Key: | OAVGBZOFDPFGPJ-UHFFFAOYSA-N |
| SMILES: | CN1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)C4=C(C(=O)NC4=O)C5=CNC6=CC=CC=C65 |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
CAMK2D, CAMK2G, MINK1, PIM2, PLK1, PRKACA, PRKCA, PRKCB, PRKCD, PRKCE, PRKCG, PRKCH, PRKCQ | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | FER, GRK5, GSK3A, GSK3B, MAP4K4, MAP4K5, MST1R, PIM1, PIM3, PKN2, PRKAA1, PRKCI, PRKG1, RPS6KA3, RPS6KB1, SGK2, SLK, STK3 |
3 (equivalent to 1µM ≤ Kd < 10 µM) | ABL1, ACVR1, AIM1, AKT1, AKT2, ALK, AURKA, AURKB, AXL, BLK, BRSK1, BTK, CAMK1, CAMK1D, CAMK2A, CAMK2B, CCNA1, CCNA2, CDC7, CDK1, CDK2, CDK5, CDK7, CDK8, CDK9, CHEK1, CHEK2, CLK2, CLK4, CSF1R, CSNK1A1, CSNK1D, CSNK1G1, CSNK1G2, CSNK1G3, CSNK2A1, DAPK3, DYRK1A, DYRK1B, DYRK3, DYRK4, EGFR, EPHA2, ERBB2, ERBB4, FES, FGFR1, FGFR3, FLG, FLT1, FLT3, FLT4, FRK, FYN, HIPK2, HIPK4, IGF1R, IKBKE, INSR, IRAK1, ITK, JAK1, JAK2, JAK3, KDR, KIT, LCK, LIMK1, LRRK2, LTK, LYN, MAP2K1, MAP2K2, MAP4K2, MAPK1, MAPK12, MAPK13, MAPK14, MAPK8, MAPK9, MAPKAPK2, MAPKAPK5, MARK3, MATK, MELK, MET, NEK2, NEK4, NTRK1, NTRK2, NTRK3, PAK4, PDGFRA, PDGFRB, PDK1, PDPK1, PHKG2, PLK3, PLK4, PRKCZ, PRKD3, PRKG2, PRKX, PTK2, RET, ROCK1, ROCK2, ROS1, SRC, SRMS, SRPK1, STK17A, SYK, TAOK1, TBK1, TNK2, TSSK1B, TSSK2, TYK2, TYRO3 |
10 (confirmed non-binding) |
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 |
Batch Information:
| HMS LINCS Batch ID | Provider | Provider Batch ID |
|---|---|---|
| 10408-101-1 | MedChem Express | 02673 |
(Kd <100 nM)