Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 2/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | PSD | A5PKW4 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13745966 | 0.87 | TYMS (0.32) | TYMSKDM4EHPGDALDH1A1MEN1 | |
| SCHEMBL13746305 | 0.85 | TYMS (0.41) | TYMSTRPV1PSDCNR1PDE2A | |
| SCHEMBL13746236 | 0.85 | TYMS (0.41) | TYMSTRPV1PSDCNR1PDE2A | |
| SCHEMBL13746410 | 0.83 | TYMS (0.39) | TYMSTRPV1PSDCNR1PDE2A | |
| SCHEMBL13746623 | 0.78 | FASN (0.37) | — | |
| SCHEMBL13747129 | 0.78 | TYMS (0.38) | TYMSTRPV1PSDCNR1PDE2A | |
| SCHEMBL4192359 | 0.77 | PSD (0.38) | TYMSTRPV1PSDCNR1PDE2A | |
| SCHEMBL13746092 | 0.77 | PSD (0.38) | TYMSTRPV1PSDCNR1PDE2A | |
| SCHEMBL4020354 | 0.76 | TRPV1 (0.41) | TYMSTRPV1PSDCNR1PDE2A | |
| SCHEMBL4020356 | 0.76 | TRPV1 (0.41) | TYMSTRPV1PSDCNR1PDE2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009100403-A1 | SUBSTITUTED ARYL PYRIMIDINONES | NEUROGEN CORPORATION (US) | 2009-08-13 | — | — | WO | disclosed |