LY2090314 - Small Molecule (ID:10378-101)
| HMS LINCS ID: |
10378-101
|
| Name: | LY2090314 |
| Alternative Names: | |
| LINCS ID: | |
| PubChem CID: | 10029385 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 512.20 |
| InChi: | InChI=1S/C28H25FN6O3/c29-18-12-17-15-34(28(38)32-7-3-1-4-8-32)11-10-33-16-20(19(13-18)25(17)33)23-24(27(37)31-26(23)36)21-14-30-22-6-2-5-9-35(21)22/h2,5-6,9,12-14,16H,1,3-4,7-8,10-11,15H2,(H,31,36,37) |
| InChi Key: | HRJWTAWVFDCTGO-UHFFFAOYSA-N |
| SMILES: | C1CCN(CC1)C(=O)N2CCN3C=C(C4=CC(=CC(=C43)C2)F)C5=C(C(=O)NC5=O)C6=CN=C7N6C=CC=C7 |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
GSK3A, GSK3B | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | CDK1, CLK4, LCK, PIM1, PKN2, PRKAA1, PRKCB, STK17A |
3 (equivalent to 1µM ≤ Kd < 10 µM) | AIM1, AKT2, AURKB, CAMK1, CDK2, CDK4, CDK5, CHEK1, CLK2, CSNK1A1, CSNK1D, CSNK1G1, CSNK1G2, CSNK1G3, CSNK2A1, DYRK1A, DYRK4, EPHA2, ERBB4, FGFR1, FLG, FLT4, HIPK2, HIPK4, INSR, IRAK1, MAP4K2, MAP4K5, MAPK1, MAPK8, MAPK9, MAPKAPK2, MARK2, MARK3, MINK1, NEK4, NTRK2, PAK4, PDK1, PDPK1, PHKG2, PIM3, PLK1, PLK3, PRKACA, PRKCD, PRKCG, PRKCI, PRKCZ, ROCK2, RPS6KA3, RPS6KB1, SLK, SRPK1, STK3, TAOK1, TGFBR2 |
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 |
|---|---|---|
| 10378-101-1 | MedChem Express | 10513 |
(Kd <100 nM)