Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 8/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | SCN2B | O60939 | 1/20 | 0.33 |
| ▸ | SCN1A | P35498 | 1/20 | 0.33 |
| ▸ | SCN1B | Q07699 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29197501 | 0.91 | GRM5 (0.38) | GRM5SCN9APIN1KDM4ENPC1 | |
| SCHEMBL30050598 | 0.88 | GRM5 (0.39) | GRM5PIN1ALDH1A1PKMSMN1; SMN2 | |
| SCHEMBL30051264 | 0.84 | KMT2A (0.40) | SCN9APIN1NPC1ALDH1A1PKM | |
| SCHEMBL30051419 | 0.82 | GRM5 (0.40) | GRM5PIN1KDM4ENPC1ALDH1A1 | |
| SCHEMBL30050124 | 0.81 | PDE7A (0.52) | GRM5KDM4ENPC1ALDH1A1PKM | |
| SCHEMBL30051153 | 0.81 | GRM5 (0.39) | GRM5SCN9ASCN2BSCN1ASCN1B | |
| SCHEMBL30051353 | 0.80 | GRM5 (0.40) | GRM5PIN1KDM4ENPC1ALDH1A1 | |
| SCHEMBL30050403 | 0.79 | GRM5 (0.41) | GRM5KDM4ENPC1ALDH1A1PKM | |
| SCHEMBL30296550 | 0.76 | MPO (0.42) | SCN9APIN1KDM4EALDH1A1MAPT | |
| SCHEMBL24570292 | 0.72 | KMT2A (0.42) | NPC1ALDH1A1PKMSMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-117940425-A | HER2 mutation inhibitors | 阿雷生物药品公司 | 2024-04-26 | — | — | CN | disclosed |
| WO-2022269531-A1 | HER2 MUTATION INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2022-12-29 | — | — | WO | disclosed |