Doramapimod - Small Molecule (ID:10169-999)
| HMS LINCS ID: |
10169-999
|
| Name: | Doramapimod |
| Alternative Names: | BIRB 796 |
| LINCS ID: | LSM-1170 |
| PubChem CID: | 156422 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 527.29 |
| InChi: | InChI=1S/C31H37N5O3/c1-22-9-11-23(12-10-22)36-29(21-28(34-36)31(2,3)4)33-30(37)32-26-13-14-27(25-8-6-5-7-24(25)26)39-20-17-35-15-18-38-19-16-35/h5-14,21H,15-20H2,1-4H3,(H2,32,33,37) |
| InChi Key: | MVCOAUNKQVWQHZ-UHFFFAOYSA-N |
| SMILES: | CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)OCCN5CCOCC5 |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-07-12 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
DDR1, DDR2, HSPB1, MAP4K4, MAPK11, MAPK12, MAPK13, Mapk14, MAPK14, MAPK9, STK10, TEK, TIE1, TKT | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | BLK, CDC42BPB, CDK19, CDK8, EPHA3, EPHA7, EPHA8, EPHB2, FLT1, KIT, MAP3K20, MAP3K7, MAPK10, MINK1, NTRK2, NTRK3, PTK2B, RET, SLK, TNIK |
3 (equivalent to 1µM ≤ Kd < 10 µM) | ABL1, ABL2, ANKK1, BRAF, CDC42BPA, CDC42BPG, CDK13, CDK5, CDK7, CHUK, CIT, CSF1R, DYRK1A, EGFR, EPHA1, EPHA2, EPHA4, EPHA5, EPHA6, EPHB1, FGFR1, FLG, FLT3, FLT4, FRK, HCK, KDR, LCK, LTK, LYN, MAP4K2, MAPK1, MAPK15, MAPK8, MERTK, MKNK1, MKNK2, MUSK, NLK, NTRK1, PDGFRA, PDGFRB, PRKCD, PRKCZ, PTK2, RAF1, RIPK2, SGK2, TAOK1, TTK, YES1 |
10 (confirmed non-binding) |
Batch Information for HMSL10169-999-2:
| HMS LINCS Batch ID: | 10169-999-2 |
| 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)