Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | DPP4 | P27487 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.38 |
| ▸ | PIM1 | P11309 | 6/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 3/20 | 0.37 |
| ▸ | PIM2 | Q9P1W9 | 3/20 | 0.37 |
| ▸ | GPR6 | P46095 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 5/20 | 0.35 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.35 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14897408 | 1.00 | CYP2D6 (0.38) | CYP2D6DPP4KCNH2IRAK4PIM1 | |
| SCHEMBL14897431 | 0.90 | ATR (0.38) | CYP2D6DPP4KCNH2ATR | |
| SCHEMBL14897380 | 0.85 | KDM4E (0.37) | CYP2D6DPP4KCNH2IRAK4MAPT | |
| SCHEMBL14897786 | 0.85 | LMNA (0.43) | CYP2D6DPP4KCNH2MAPTNTRK1 | |
| SCHEMBL14897709 | 0.83 | CSNK1E (0.36) | CYP2D6DPP4KCNH2IRAK4CSNK1E | |
| SCHEMBL16193117 | 0.83 | IRAK4 (0.53) | IRAK4PIM1PIM3PIM2ATR | |
| SCHEMBL14897799 | 0.82 | NTRK1 (0.39) | CYP2D6DPP4KCNH2IRAK4CSNK1E | |
| SCHEMBL14896928 | 0.81 | GRM5 (0.41) | NTRK1 | |
| SCHEMBL14897303 | 0.80 | NTRK1 (0.41) | NTRK1NTRK3NTRK2 | |
| SCHEMBL14897385 | 0.79 | GLS (0.39) | CYP2D6DPP4KCNH2IRAK4NTRK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2768509-B1 | SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2017-03-22 | — | — | EP | disclosed |