Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NEK2 | P51955 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.32 |
| ▸ | MTOR | P42345 | 5/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.32 |
| ▸ | PIM2 | Q9P1W9 | 5/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 2/20 | 0.31 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.30 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.30 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19706067 | 1.00 | NEK2 (0.34) | NEK2FFAR4MTORPIK3CAPIM2 | |
| SCHEMBL19365493 | 0.88 | FAAH (0.40) | NEK2MTORPIK3CADYRK1AALDH1A1 | |
| SCHEMBL19706066 | 0.87 | FAAH (0.35) | NEK2PIM2DYRK1A | |
| SCHEMBL19670259 | 0.87 | FAAH (0.35) | NEK2PIM2DYRK1A | |
| SCHEMBL17618435 | 0.87 | GRM5 (0.36) | NEK2FFAR4ALDH1A1GAABRAF | |
| SCHEMBL19670254 | 0.87 | NEK2 (0.34) | NEK2MTORPIK3CADYRK1ACYP1A2 | |
| SCHEMBL17618601 | 0.87 | POLQ (0.38) | NEK2FFAR4MTORPIK3CADYRK1A | |
| SCHEMBL19670287 | 0.85 | PHGDH (0.38) | ALDH1A1GAAHPGDHPGDS | |
| SCHEMBL17618490 | 0.85 | GPR6 (0.40) | NEK2BRAF | |
| SCHEMBL19365385 | 0.85 | CNR2 (0.35) | DYRK1AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |