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) |
Batch Information for HMSL10354-101-1:
| HMS LINCS Batch ID: | 10354-101-1 |
| Provider: | Selleck Chemicals |
| Provider Batch ID: | S285101 |
| Salt: | 101 |
| Molecular Formula: | C16H17N7O2S |
| Molecular Weight: | 371.42 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2014-06-26 |
| Most Recent Update: | 2016-04-04 |
HMS QC Testing Events for HMSL10354-101-1:
| Date | HMS QC Outcome | Comment | Files |
|---|---|---|---|
| 04/13/2015 | PASS | HMSL10354-101-1_NMR.pdf, HMSL10354-101-1_LCMS.pdf |
(Kd <100 nM)