Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SCN2A | Q99250 | 4/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.39 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.39 |
| ▸ | AHR | P35869 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CCR1 | P32246 | 2/20 | 0.35 |
| ▸ | CCR8 | P51685 | 2/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | HPGDS | O60760 | 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 | |
|---|---|---|---|---|
| SCHEMBL2458581 | 0.79 | SMN1; SMN2 (0.38) | ALDH1A1HPGDTSHRHSD17B10CYP3A4 | |
| SCHEMBL5740853 | 0.77 | ALDH1A1 (0.41) | ALDH1A1AHRTSHRHSD17B10CYP3A4 | |
| SCHEMBL2666281 | 0.76 | L3MBTL1 (0.40) | ALDH1A1SCN2ASCN9ASCN3ASCN10A | |
| SCHEMBL2930780 | 0.75 | ALDH1A1 (0.69) | ALDH1A1SCN2ASCN9ASCN3ASCN10A | |
| SCHEMBL3453300 | 0.74 | GRM5 (0.51) | ALDH1A1AHRHPGDTSHRHSD17B10 | |
| SCHEMBL6439475 | 0.71 | CNR2 (0.50) | SCN2ASCN9ASCN3ASCN10ATSHR | |
| SCHEMBL3425873 | 0.71 | CES1 (0.34) | HPGDCYP3A4CCR1CCR8CCR5 | |
| SCHEMBL4459668 | 0.71 | ALDH1A1 (0.61) | ALDH1A1SCN2AAHRHPGDTSHR | |
| SCHEMBL4451811 | 0.69 | ALDH1A1 (0.58) | ALDH1A1SCN2AAHRHPGDTSHR | |
| SCHEMBL4459067 | 0.69 | ALDH1A1 (0.58) | ALDH1A1SCN2AAHRHPGDTSHR |
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-20100029613-A1 | TREATMENT AND PREVENTION OF EPILEPSY | UNIVERSITY OF ROCHESTER (US) | 2010-02-04 | — | — | US | disclosed |