Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | CASR | P41180 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29135368 | 0.84 | SGK1 (0.40) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL30009135 | 0.84 | SGK1 (0.40) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL30008895 | 0.84 | TDO2 (0.39) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL8273119 | 0.84 | ALDH1A1 (0.50) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL13444511 | 0.83 | ALDH1A1 (0.47) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL30008462 | 0.82 | BTK (0.52) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL29135371 | 0.80 | MAPT (0.40) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL30008288 | 0.80 | RXRA (0.43) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL30008279 | 0.80 | MAPT (0.40) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL29135366 | 0.80 | RXRA (0.43) | ALDH1A1KDM4ENPC1RAB9AHPGD |
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-117143017-B | Method for constructing isoquinoline compound based on aryl migration strategy, hole transport material molecule and preparation method thereof, perovskite solar cell and preparation method thereof | 广东工业大学 | 2026-05-19 | — | — | CN | disclosed |
| CN-117143017-A | Method for constructing isoquinoline compound based on aryl migration strategy, hole transport material molecule and preparation method thereof, perovskite solar cell and preparation method thereof | 广东工业大学 | 2023-12-01 | — | — | CN | disclosed |