Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | UBE2N | P61088 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29133089 | 0.85 | ALDH1A1 (0.53) | TP53KMT2AALDH1A1MEN1MAPT | |
| SCHEMBL24595665 | 0.83 | ALDH1A1 (0.48) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL30622253 | 0.83 | ALDH1A1 (0.48) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL256771 | 0.81 | NOTUM (0.50) | TP53KMT2AALDH1A1MEN1MAPT | |
| SCHEMBL30622268 | 0.81 | NOTUM (0.50) | TP53KMT2AALDH1A1MEN1MAPT | |
| SCHEMBL408849 | 0.80 | CA1 (0.44) | ALDH1A1KDM4EL3MBTL1LMNARAB9A | |
| SCHEMBL29133180 | 0.77 | GSK3B (0.49) | KMT2AALDH1A1MEN1MAPTGAA | |
| SCHEMBL7829370 | 0.76 | CHRNA1 (0.48) | TP53KMT2AALDH1A1MEN1MAPT | |
| SCHEMBL30602390 | 0.76 | ALDH1A1 (0.42) | KMT2AALDH1A1MEN1SMN1; SMN2 | |
| SCHEMBL848696 | 0.76 | KMT2A (0.51) | TP53KMT2AALDH1A1MEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-117088884-A | Imidazopyridazine derivatives as GABAA receptor modulators, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-21 | — | — | CN | disclosed |