IP6K/IP3K inhibitor - Small Molecule (ID:10455-101)
| HMS LINCS ID: |
10455-101
|
| Name: | IP6K/IP3K inhibitor |
| Alternative Names: | 519178-28-0 |
| LINCS ID: | |
| PubChem CID: | 16760513 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 443.13 |
| InChi: | InChI=1S/C20H16F3N7O2/c21-20(22,23)14-3-1-2-13(8-14)10-25-19-28-17(16-18(29-19)27-11-26-16)24-9-12-4-6-15(7-5-12)30(31)32/h1-8,11H,9-10H2,(H3,24,25,26,27,28,29) |
| InChi Key: | DDSBPUYZPWNNGH-UHFFFAOYSA-N |
| SMILES: | C1=CC(=CC(=C1)C(F)(F)F)CNC2=NC3=C(C(=N2)NCC4=CC=C(C=C4)[N+](=O)[O-])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 |
|---|---|
IP6K1, IP6K2, IP6K3 | |
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 |
|---|---|---|
| 10455-101-1 | EMD Millipore | D00176632 |
(equivalent to 100 nM ≤ Kd < 1µM)