Entinostat - Small Molecule (ID:10311-101)
| HMS LINCS ID: |
10311-101
|
| Name: | Entinostat |
| Alternative Names: | MS-275; MS-27-275 |
| LINCS ID: | LSM-4811 |
| PubChem CID: | 4261 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 376.15 |
| InChi: | InChI=1S/C21H20N4O3/c22-18-5-1-2-6-19(18)25-20(26)17-9-7-15(8-10-17)13-24-21(27)28-14-16-4-3-11-23-12-16/h1-12H,13-14,22H2,(H,24,27)(H,25,26) |
| InChi Key: | INVTYAOGFAGBOE-UHFFFAOYSA-N |
| SMILES: | C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC(=O)OCC3=CN=CC=C3 |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
HDAC1, HDAC2, HDAC3 | |
3 (equivalent to 1µM ≤ Kd < 10 µM) | F3, HDAC10, HDAC11, HDAC4, HDAC5, HDAC7, HDAC8, HDAC9 |
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 |
| 20276 | Protein levels measured by imaging in BRAF(V600E/D) melanoma cell lines following treatment with Vemurafenib in combination with chromatin-targeting compounds (immunofluorescence dataset 3 of 4) | Microscopy/Imaging |
Batch Information:
| HMS LINCS Batch ID | Provider | Provider Batch ID |
|---|---|---|
| 10311-101-1 | Haoyuan chemexpress | HY-12163-20130407 |
(equivalent to 100 nM ≤ Kd < 1µM)