Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL24770338 | 0.77 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL21503761 | 0.74 | — | — | |
| SCHEMBL18714044 | 0.72 | — | — | |
| SCHEMBL25156142 | 0.71 | ALDH1A1 (0.48) | ALDH1A1MAPTEGLN1OPRK1 | |
| SCHEMBL2246387 | 0.71 | — | — | |
| SCHEMBL19366418 | 0.71 | — | — | |
| SCHEMBL822962 | 0.69 | — | — | |
| SCHEMBL62213 | 0.69 | — | — | |
| SCHEMBL62212 | 0.69 | — | — | |
| SCHEMBL23369533 | 0.69 | ALDH1A1 (0.38) | ALDH1A1EGLN1 |
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-2022259204-A1 | O-LINKED THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2022-12-15 | — | — | WO | disclosed |