Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27596164 | 0.81 | ALDH1A1 (0.37) | ALDH1A1HPGDHSD17B10TAS2R38 | |
| SCHEMBL15328337 | 0.73 | MEN1 (0.36) | ALDH1A1TAS2R38 | |
| SCHEMBL5120839 | 0.73 | MEN1 (0.41) | ALDH1A1HPGDLMNA | |
| SCHEMBL4047411 | 0.72 | CYP2D6 (0.45) | ALDH1A1LMNA | |
| SCHEMBL5128168 | 0.71 | KDM4E (0.41) | ALDH1A1HPGDLMNA | |
| SCHEMBL38656309 | 0.70 | — | — | |
| SCHEMBL1493634 | 0.70 | — | — | |
| SCHEMBL28883694 | 0.70 | PRMT1 (0.30) | — | |
| SCHEMBL31613206 | 0.69 | CYP2D6 (0.43) | ALDH1A1LMNA | |
| SCHEMBL28186081 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024044271-A2 | METAL CHELATOR COMPOUNDS, COORDINATION COMPLEXES, AND METHODS OF PREPARATION AND USE THEREOF | UNIVERSITY OF PUERTO RICO (US) | 2024-02-29 | — | — | WO | disclosed |