H89 - Small Molecule (ID:10411-102)
| HMS LINCS ID: |
10411-102
|
| Name: | H89 |
| Alternative Names: | |
| LINCS ID: | |
| PubChem CID: | 5702541 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 445.05 |
| InChi: | InChI=1S/C20H20BrN3O2S/c21-18-8-6-16(7-9-18)3-2-11-22-13-14-24-27(25,26)20-5-1-4-17-15-23-12-10-19(17)20/h1-10,12,15,22,24H,11,13-14H2/b3-2+ |
| InChi Key: | ZKZXNDJNWUTGDK-NSCUHMNNSA-N |
| SMILES: | C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NCCNC/C=C/C3=CC=C(C=C3)Br |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
RPS6KB1 | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | AKT2, AKT3, PRKACA, PRKACA, PRKACB, PRKACB, PRKACG, PRKAR2A, PRKAR2B, PRKX, ROCK2, RPS6KA5 |
3 (equivalent to 1µM ≤ Kd < 10 µM) | AKT1 |
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 |
|---|---|---|
| 10411-102-1 | MedChem Express | 13164 |
(Kd <100 nM)