Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | CNR1 | P21554 | 3/20 | 0.42 |
| ▸ | CNR2 | P34972 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | G6PD | P11413 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | MGLL | Q99685 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23374492 | 0.98 | MAPT (0.46) | MAPTCNR1CNR2ALDH1A1TP53 | |
| SCHEMBL17247762 | 0.95 | MAPT (0.46) | MAPTCNR1CNR2DRD3NPC1 | |
| SCHEMBL6985244 | 0.87 | KMT2A (0.43) | MAPTCNR1CNR2ALDH1A1DRD3 | |
| SCHEMBL29161576 | 0.84 | KMT2A (0.38) | MAPTNPC1RAB9AKMT2A | |
| SCHEMBL13896708 | 0.82 | DRD3 (0.39) | MAPTCNR1ALDH1A1TP53HSP90AA1 | |
| SCHEMBL15885287 | 0.80 | CNR1 (0.42) | MAPTCNR1CNR2ALDH1A1TP53 | |
| SCHEMBL252411 | 0.79 | KMT2A (0.41) | MAPTCNR1ALDH1A1CYP3A4HPGD | |
| SCHEMBL1425536 | 0.79 | ALDH1A1 (0.41) | CNR1CNR2ALDH1A1TP53HSP90AA1 | |
| SCHEMBL11614007 | 0.77 | TLR8 (0.49) | MAPTALDH1A1TP53HSP90AA1CYP3A4 | |
| SCHEMBL3860760 | 0.77 | KMT2A (0.40) | MAPTALDH1A1NPC1RAB9AKMT2A |
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-3774799-B1 | NEK6 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF SOLID TUMORS | CONSIGLIO NAZIONALE RICERCHE (IT) | 2023-07-12 | — | — | EP | disclosed |