Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.40 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.37 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | CTSG | P08311 | 1/20 | 0.37 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.37 |
| ▸ | PARK7 | Q99497 | 2/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | TGM2 | P21980 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7288574 | 0.94 | ALDH1A1 (0.44) | ALDH1A1ALDH2ALDH3A1ADRA1DSLC5A2 | |
| SCHEMBL7287349 | 0.80 | MAPT (0.41) | ALDH1A1SLC5A2TP53SMN1; SMN2ELANE | |
| SCHEMBL7288496 | 0.79 | GRM2 (0.40) | SLC5A2ELANECTSGPRTN3PTGDR2 | |
| SCHEMBL7288613 | 0.78 | ALDH1A1 (0.41) | ALDH1A1ALDH2ALDH3A1PKMADRA1D | |
| SCHEMBL7281540 | 0.78 | NLRP3 (0.41) | ALDH1A1TP53SMN1; SMN2CA2CA9 | |
| SCHEMBL7291581 | 0.78 | SCN9A (0.43) | ALDH1A1PKMTP53GSK3AGSK3B | |
| Hydrochloric Acid SCHEMBL7280882 | 0.78 | ALDH1A1 (0.40) | ALDH1A1ALDH2ALDH3A1PKMADRA1D | |
| SCHEMBL10427989 | 0.76 | CA12 (0.39) | SMN1; SMN2PTGDR2CA2CA9 | |
| Hydrochloric Acid SCHEMBL7290990 | 0.75 | ELANE (0.43) | ALDH1A1ALDH2ALDH3A1SLC5A2TP53 | |
| SCHEMBL9488302 | 0.74 | DRD2 (0.40) | ALDH1A1ALDH2ALDH3A1ADRA1DSLC5A2 |
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-0313393-B1 | Benzoxazine compounds and pharmaceutical use thereof | YOSHITOMI PHARMACEUTICAL (JP) | 1994-03-16 | — | — | EP | disclosed |
| US-4892872-A | ANTIEMETICS, ANTINAUSEA | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1990-01-09 | — | — | US | disclosed |