Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALB | P02768 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 2/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.48 |
| ▸ | PRNP | P04156 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | FABP4 | P15090 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.42 |
| ▸ | FEN1 | P39748 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29570698 | 0.91 | PRNP (0.50) | ALBCES2CES1PRNPALDH1A1 | |
| SCHEMBL146386 | 0.91 | PRNP (0.50) | ALBCES2CES1PRNPALDH1A1 | |
| SCHEMBL97828 | 0.82 | CES2 (0.68) | ALBCES2CES1ALDH1A1ALOX15 | |
| SCHEMBL29362443 | 0.82 | CES2 (0.68) | ALBCES2CES1ALDH1A1ALOX15 | |
| SCHEMBL30968201 | 0.82 | CES2 (0.68) | ALBCES2CES1ALDH1A1ALOX15 | |
| Hydrochloric Acid SCHEMBL23201659 | 0.80 | CES2 (0.65) | ALBCES2CES1ALDH1A1ALOX15 | |
| SCHEMBL10357059 | 0.80 | CES2 (0.65) | ALBCES2CES1ALDH1A1ALOX15 | |
| SCHEMBL11451385 | 0.80 | CES2 (0.65) | ALBCES2CES1ALDH1A1ALOX15 | |
| Hydrochloric Acid SCHEMBL6592453 | 0.80 | CES2 (0.65) | ALBCES2CES1ALDH1A1ALOX15 | |
| SCHEMBL9015790 | 0.80 | CES2 (0.65) | ALBCES2CES1ALDH1A1ALOX15 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3160967-A1 | IMIDAZO[1,2-A]PYRAZIN-1YL-BENZAMIDE COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY | F. Hoffmann-La Roche AG (CH) | 2017-05-03 | — | — | EP | disclosed |
| WO-2015197503-A1 | IMIDAZO[1,2-A]PYRAZIN-1YL-BENZAMIDE COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY | F. HOFFMANN-LA ROCHE AG (CH) | 2015-12-30 | — | — | WO | disclosed |