Baricitinib - Small Molecule (ID:10354-101)
| HMS LINCS ID: |
10354-101
|
| Name: | Baricitinib |
| Alternative Names: | INCB028050; LY3009104 |
| LINCS ID: | LSM-6709 |
| PubChem CID: | 44205240 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 371.12 |
| InChi: | InChI=1S/C16H17N7O2S/c1-2-26(24,25)22-9-16(10-22,4-5-17)23-8-12(7-21-23)14-13-3-6-18-15(13)20-11-19-14/h3,6-8,11H,2,4,9-10H2,1H3,(H,18,19,20) |
| InChi Key: | XUZMWHLSFXCVMG-UHFFFAOYSA-N |
| SMILES: | CCS(=O)(=O)N1CC(C1)(CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC=N3 |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
JAK1, JAK2, TYK2 | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | BMP2K, CAMK2A, JAK3, MAP3K2, PRPF4B, ROCK1, ROCK2 |
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 |
| 20227 | Baricitinib KINOMEscan | KINOMEscan |
| 20369 | Binding affinity of 6 small molecule JAK inhibitors for 5 kinases | Affinity Data |
Batch Information:
| HMS LINCS Batch ID | Provider | Provider Batch ID |
|---|---|---|
| 10354-101-1 | Selleck Chemicals | S285101 |
(Kd <100 nM)