Barasertib - Small Molecule (ID:10426-101)
| HMS LINCS ID: |
10426-101
|
| Name: | Barasertib |
| Alternative Names: | AZD1152 |
| LINCS ID: | |
| PubChem CID: | 11497983 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 587.21 |
| InChi: | InChI=1S/C26H31FN7O6P/c1-2-34(10-12-40-41(36,37)38)9-4-11-39-21-7-8-22-23(16-21)28-17-29-26(22)31-24-14-20(32-33-24)15-25(35)30-19-6-3-5-18(27)13-19/h3,5-8,13-14,16-17H,2,4,9-12,15H2,1H3,(H,30,35)(H2,36,37,38)(H2,28,29,31,32,33) |
| InChi Key: | GBJVVSCPOBPEIT-UHFFFAOYSA-N |
| SMILES: | CCN(CCCOC1=CC2=C(C=C1)C(=NC=N2)NC3=NNC(=C3)CC(=O)NC4=CC(=CC=C4)F)CCOP(=O)(O)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 |
|---|---|
AIM1, AURKB, AURKC, KIT | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | FLT3, KDR, PDGFRA, PDGFRB, RET |
3 (equivalent to 1µM ≤ Kd < 10 µM) | ABL1, ACVR1, ALK, AURKA, BTK, CAMK1D, CAMK2A, CAMKK2, CDK5, CDK7, CDK8, CDK9, CHEK1, CLK2, CLK4, CSF1R, CSNK1A1, DAPK3, DYRK1A, DYRK1B, FGFR1, FLG, FLT1, FYN, GRK5, GSK3A, GSK3B, HCK, IGF1R, IKBKE, JAK2, JAK3, LCK, LIMK1, LRRK2, LTK, MAP2K1, MAP2K2, MAP3K10, MAP4K2, MAP4K4, MAPK10, MAPK14, MAPK8, MAPK9, MARK3, MARK4, MELK, MET, MST1R, NEK2, NTRK1, NTRK2, NTRK3, PAK4, PIM1, PRKAA1, PRKACA, PRKCQ, PRKD3, PRKX, PTK2, ROCK1, ROCK2, ROS1, RPS6KA3, SGK2, SIK2, STK3, TAOK1, TBK1, TNK2, TYRO3 |
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 |
|---|---|---|
| 10426-101-1 | MedChem Express | 13477 |
(Kd <100 nM)