Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28473212 | 0.95 | ALDH1A1 (0.46) | HTTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL28486029 | 0.92 | L3MBTL1 (0.43) | HTTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL28474493 | 0.86 | HTT (0.47) | HTTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL29202924 | 0.86 | MAPT (0.56) | HTTALDH1A1KMT2AMAPT | |
| SCHEMBL28480715 | 0.82 | KMT2A (0.47) | HTTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL28472349 | 0.82 | HTT (0.44) | HTTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL28482466 | 0.82 | SMN1; SMN2 (0.44) | HTTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL29202914 | 0.81 | ALDH1A1 (0.40) | HTTALDH1A1SMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL28901016 | 0.79 | L3MBTL1 (0.46) | HTTALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL28485413 | 0.78 | ALDH1A1 (0.53) | HTTALDH1A1CYP1A2CYP3A4CYP2C19 |
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-111918864-B | Prodrug compounds activated by AKR1C3 and their use for the treatment of hyperproliferative disorders | 阿基利斯医疗有限公司 | 2024-03-05 | — | — | CN | disclosed |
| CN-111918864-A | Prodrug compounds activated by AKR1C3 and their use to treat hyperproliferative disorders | 阿基利斯医疗有限公司 | 2020-11-10 | — | — | CN | disclosed |