Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.64 |
| ▸ | HPGD | P15428 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14228270 | 0.82 | ALDH1A1 (0.50) | ALDH1A1HPGDTDP1NPC1RAB9A | |
| SCHEMBL4992581 | 0.81 | ALDH1A1 (0.50) | ALDH1A1HPGDTDP1NPC1RAB9A | |
| SCHEMBL9080677 | 0.80 | ALDH1A1 (0.40) | ALDH1A1HPGDTDP1NPC1RAB9A | |
| SCHEMBL5201436 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HPGDTDP1NPC1RAB9A | |
| SCHEMBL31347487 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HPGDTDP1NPC1RAB9A | |
| SCHEMBL4132222 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HPGDTDP1NPC1RAB9A | |
| SCHEMBL31347542 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HPGDTDP1NPC1RAB9A | |
| SCHEMBL3842149 | 0.80 | ALDH1A1 (0.70) | ALDH1A1HPGDTDP1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL7564936 | 0.79 | ALDH1A1 (0.45) | ALDH1A1HPGDTDP1NPC1RAB9A | |
| SCHEMBL181041 | 0.79 | ALDH1A1 (1.00) | ALDH1A1HPGDTDP1NPC1RAB9A |
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 |