Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.52 |
| ▸ | AGER | Q15109 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27177337 | 0.86 | ALDH1A1 (0.57) | ALDH1A1MAPTMCOLN3LMNAKDM4E | |
| SCHEMBL11326000 | 0.84 | KEAP1 (0.57) | ALDH1A1MAPTMCOLN3LMNAKDM4E | |
| SCHEMBL5444163 | 0.82 | TSHR (0.50) | ALDH1A1LMNACA12CA9TSHR | |
| SCHEMBL16316833 | 0.82 | KMT2A (0.57) | ALDH1A1LMNATSHRKEAP1NFE2L2 | |
| SCHEMBL28877340 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MAPTMCOLN3LMNAKDM4E | |
| SCHEMBL7924228 | 0.82 | HSD11B1 (0.67) | ALDH1A1MAPTLMNAKDM4ECA12 | |
| SCHEMBL5880393 | 0.81 | HSD11B1 (0.66) | ALDH1A1MAPTMCOLN3LMNAKDM4E | |
| SCHEMBL25394343 | 0.79 | ALDH1A1 (0.55) | ALDH1A1MAPTMCOLN3LMNAKDM4E | |
| SCHEMBL13302609 | 0.79 | AGER (0.51) | ALDH1A1MAPTMCOLN3LMNAKDM4E | |
| SCHEMBL5444159 | 0.79 | CA2 (0.53) | ALDH1A1MAPTCA12CA9TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024022471-A1 | KRAS INHIBITOR COMPOUND | 上海湃隆生物科技有限公司 | 2024-02-01 | — | — | WO | disclosed |
| CN-116675727-A | Method for synthesizing amide and/or polypeptide by taking unprotected amino acid as ammonia component | 广州医科大学 | 2023-09-01 | — | — | CN | disclosed |
| CN-116675726-A | Method for synthesizing amide and/or polypeptide by using temporarily protected amino acid as ammonia component | 广州医科大学 | 2023-09-01 | — | — | CN | disclosed |