Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | CRHBP | P24387 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | KRAS | P01116 | 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 | |
|---|---|---|---|---|
| SCHEMBL25408956 | 0.74 | ALDH1A1 (0.38) | ALDH1A1POLBRXFP1KMT2ACASP1 | |
| SCHEMBL28540708 | 0.66 | KMT2A (0.34) | ALDH1A1POLBRXFP1KMT2AKRAS | |
| SCHEMBL30512910 | 0.64 | ALDH1A1 (0.33) | ALDH1A1POLBRXFP1 | |
| SCHEMBL25408836 | 0.64 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL30512999 | 0.62 | MAPK8 (0.39) | ALDH1A1KMT2AMEN1TDP1KDM4E | |
| SCHEMBL23252363 | 0.62 | ALDH1A1 (0.53) | ALDH1A1POLBRXFP1KMT2AMEN1 | |
| SCHEMBL30512959 | 0.61 | TDP1 (0.36) | ALDH1A1KMT2ACASP1CASP7HSD17B10 | |
| SCHEMBL4596137 | 0.60 | ALDH1A1 (1.00) | ALDH1A1POLBRXFP1KMT2AMEN1 | |
| SCHEMBL25410972 | 0.59 | — | — | |
| SCHEMBL21617924 | 0.58 | KDM1A (0.38) | ALDH1A1KMT2AMEN1TDP1KDM4E |
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-2023138612-A1 | HETEROCYCLIC COMPOUNDS USEFUL AS HPK1 INHIBITORS | SILEXON AI TECHNOLOGY CO., LTD. (CN) | 2023-07-27 | — | — | WO | disclosed |