Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | GABRP | O00591 | 1/20 | 0.37 |
| ▸ | GABRD | O14764 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30578684 | 0.88 | ALOX15B (0.44) | ALDH1A1ALOX15BCA1CA2RAB9A | |
| SCHEMBL30578686 | 0.88 | THRB (0.45) | ALDH1A1ALOX15BRAB9ANPC1 | |
| SCHEMBL29082339 | 0.84 | ALDH1A1 (0.41) | ALDH1A1ALOX15BRAB9AUSP2HPGD | |
| SCHEMBL29082336 | 0.84 | ALDH1A1 (0.41) | ALDH1A1ALOX15BRAB9AUSP2HPGD | |
| SCHEMBL30578697 | 0.84 | ALDH1A1 (0.41) | ALDH1A1ALOX15BCA1CA2RAB9A | |
| SCHEMBL29988217 | 0.83 | ALDH1A1 (0.41) | ALDH1A1ALOX15BRAB9AUSP2HPGD | |
| SCHEMBL29988293 | 0.80 | RAB9A (0.41) | ALDH1A1ALOX15BADCY1RAB9AUSP2 | |
| SCHEMBL30685472 | 0.79 | RAB9A (0.41) | ALDH1A1ALOX15BRAB9AUSP2HPGD | |
| SCHEMBL31088206 | 0.77 | RAB9A (0.40) | ALDH1A1ALOX15BCYP2C19RAB9AUSP2 | |
| SCHEMBL29988906 | 0.76 | MTNR1A (0.41) | ALDH1A1ALOX15BRAB9AUSP2HPGD |
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-2023231948-A1 | ISR INHIBITORS, METHOD FOR PREPARING SAME, AND USE THEREOF | 中国药科大学 | 2023-12-07 | — | — | WO | disclosed |