Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 9/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.39 |
| ▸ | GALR3 | O60755 | 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 | |
|---|---|---|---|---|
| SCHEMBL4535995 | 0.81 | ALDH1A1 (0.54) | ALDH1A1KDM4EHCAR3HTTMAPT | |
| SCHEMBL4795854 | 0.78 | ALDH1A1 (0.59) | ALDH1A1KDM4EHCAR3HTTMAPT | |
| SCHEMBL31347536 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KDM4EHCAR3HTTMAPT | |
| SCHEMBL16654008 | 0.77 | ALDH1A1 (0.55) | ALDH1A1HTTMAPTSMN1; SMN2LMNA | |
| SCHEMBL992165 | 0.77 | TDP1 (0.61) | ALDH1A1MAPTMAPK1LMNAL3MBTL1 | |
| SCHEMBL1467557 | 0.76 | MAPK1 (0.61) | ALDH1A1KDM4EMAPTMAPK1SMN1; SMN2 | |
| SCHEMBL11315742 | 0.75 | PDK1 (0.48) | ALDH1A1KDM4EHTTMAPTMAPK1 | |
| SCHEMBL2742574 | 0.75 | ALDH1A1 (0.61) | ALDH1A1KDM4EHTTMAPK1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9302696 | 0.74 | MAPT (0.62) | ALDH1A1KDM4EMAPTMAPK1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11313217 | 0.74 | PDK1 (0.47) | ALDH1A1KDM4EHTTMAPTMAPK1 |
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-119591621-A | Novel ecteinascidin derivatives, preparation method and application thereof, antibody drug conjugate and application thereof | 泰诚思(上海)生物医药有限公司 | 2025-03-11 | — | — | CN | disclosed |