XL413 - Small Molecule (ID:10389-102)
| HMS LINCS ID: |
10389-102
|
| Name: | XL413 |
| Alternative Names: | |
| LINCS ID: | |
| PubChem CID: | 57899889 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 289.06 |
| InChi: | InChI=1S/C14H12ClN3O2/c15-7-3-4-10-8(6-7)11-12(20-10)14(19)18-13(17-11)9-2-1-5-16-9/h3-4,6,9,16H,1-2,5H2,(H,17,18,19)/t9-/m0/s1 |
| InChi Key: | JJWLXRKVUJDJKG-VIFPVBQESA-N |
| SMILES: | O=C1NC([C@@H]2CCCN2)=NC3=C1OC4=C3C=C(Cl)C=C4 |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
PIM1 | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | CDC7 |
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 |
|---|---|---|
| 10389-102-1 | MedChem Express | 10815 |
(Kd <100 nM)