Barasertib - Small Molecule (ID:10067-999)
| HMS LINCS ID: |
10067-999
|
| Name: | Barasertib |
| Alternative Names: | AZD1152-HQPA |
| LINCS ID: | LSM-1067 |
| PubChem CID: | 16007391 |
| ChEBI ID: | |
| ChEMBL ID: | 215152 |
| Molecular Mass: | 507.24 |
| InChi: | InChI=1S/C26H30FN7O3/c1-2-34(10-11-35)9-4-12-37-21-7-8-22-23(16-21)28-17-29-26(22)31-24-14-20(32-33-24)15-25(36)30-19-6-3-5-18(27)13-19/h3,5-8,13-14,16-17,35H,2,4,9-12,15H2,1H3,(H,30,36)(H2,28,29,31,32,33) |
| InChi Key: | QYZOGCMHVIGURT-UHFFFAOYSA-N |
| SMILES: | CCN(CCCOC1=CC2=C(C=C1)C(=NC=N2)NC3=NNC(=C3)CC(=O)NC4=CC(=CC=C4)F)CCO |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-07-12 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
AIM1, AURKB, AURKC, EPHB6, HIPK4, KIT, MAP2K5, PDGFRA, PDGFRB | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | AURKA, AXL, ERBB4, FLT1, FLT3, KDR, LCK, MAP3K7, MAP4K5, RET, TIE1, Tuba1a |
3 (equivalent to 1µM ≤ Kd < 10 µM) | AAK1, ABL1, ANKK1, BLK, BTK, CDK1, CDK11A, CDK11B, CDK13, CDK16, CDK7, CDKL2, CHEK2, CHUK, CIT, CSF1R, CSK, CSNK1A1, DDR1, DDR2, DSTYK, DYRK1A, EGFR, EIF2AK1, ERBB2, FLT4, GRK5, HCK, HIPK2, HIPK3, IRAK3, LTK, LYN, MAP2K1, MAP2K2, MAP3K19, MAP3K20, MAP4K2, MAPK13, MET, MKNK2, MST1R, MUSK, PLK4, PRKCG, PRKCZ, RIPK2, ROCK1, ROCK2, RPS6KB1, SRMS, STK10, STK36, TAOK1, TBK1, TEK, TKT, TNIK, TTK, YES1 |
10 (confirmed non-binding) |
Batch Information for HMSL10067-999-4:
| HMS LINCS Batch ID: | 10067-999-4 |
| Provider: | |
| Provider Batch ID: | |
| Salt: | 999 |
| Molecular Formula: | |
| Molecular Weight: | |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2016-05-27 |
| Most Recent Update: | 2016-12-02 |
(Kd <100 nM)