Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.31 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | TUBB1 | Q9H4B7 | 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 | |
|---|---|---|---|---|
| SCHEMBL17384691 | 0.81 | KMT2A (0.37) | ALDH1A1KMT2AMEN1NPSR1 | |
| SCHEMBL9333597 | 0.79 | ACHE (0.37) | ALDH1A1KMT2AMEN1NPSR1TUBB1 | |
| SCHEMBL24386895 | 0.79 | ALDH1A1 (0.34) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL24501260 | 0.76 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL30128522 | 0.75 | PDE10A (0.31) | ALDH1A1PDE10A | |
| SCHEMBL21932394 | 0.75 | PDE10A (0.31) | ALDH1A1PDE10A | |
| SCHEMBL4374780 | 0.75 | HTR2A (0.38) | ALDH1A1KMT2AMEN1NPSR1TUBB1 | |
| SCHEMBL20594900 | 0.75 | KDM4E (0.41) | ALDH1A1KMT2APDE10AMEN1 | |
| SCHEMBL12677154 | 0.74 | CYP3A4 (0.40) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL26359989 | 0.72 | CCR1 (0.41) | — |
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-2022118210-A1 | SUBSTITUTED THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2022-06-09 | — | — | WO | disclosed |