Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.56 |
| ▸ | HPGD | P15428 | 8/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.56 |
| ▸ | RAB9A | P51151 | 5/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | LMNA | P02545 | 4/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 3/20 | 0.43 |
| ▸ | MMP2 | P08253 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21490329 | 0.86 | ULK1 (0.53) | ALDH1A1HPGDKDM4ERAB9ANPC1 | |
| SCHEMBL28844724 | 0.85 | ALDH1A1 (0.58) | ALDH1A1HPGDKDM4ERAB9ANPC1 | |
| SCHEMBL703198 | 0.85 | KDM4E (0.58) | ALDH1A1HPGDKDM4ERAB9ANPC1 | |
| SCHEMBL2820122 | 0.85 | KDM4E (0.50) | ALDH1A1HPGDKDM4ERAB9ANPC1 | |
| SCHEMBL29813118 | 0.85 | KDM4E (0.54) | ALDH1A1HPGDKDM4ERAB9ANPC1 | |
| SCHEMBL23147929 | 0.85 | KDM4E (0.54) | ALDH1A1HPGDKDM4ERAB9ANPC1 | |
| SCHEMBL8200409 | 0.83 | ALDH1A1 (0.53) | ALDH1A1HPGDKDM4ERAB9ANPC1 | |
| SCHEMBL4037610 | 0.82 | KDM4E (0.48) | ALDH1A1HPGDKDM4ERAB9ANPC1 | |
| SCHEMBL31405949 | 0.82 | KDM4E (0.48) | ALDH1A1HPGDKDM4ERAB9ANPC1 | |
| SCHEMBL22620680 | 0.80 | KDM4E (0.51) | ALDH1A1HPGDKDM4ERAB9ANPC1 |
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-118530160-A | Aromatic heterocyclic compound, preparation method and application thereof | 上海翊石医药科技有限公司 | 2024-08-23 | — | — | CN | disclosed |