Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25946281 | 0.87 | ALDH1A1 (0.44) | ALDH1A1NPSR1L3MBTL1TSHRGAA | |
| SCHEMBL25946279 | 0.80 | LMNA (0.39) | ALDH1A1NPSR1L3MBTL1TSHRGAA | |
| SCHEMBL1161316 | 0.80 | ALDH1A1 (0.67) | ALDH1A1NPSR1L3MBTL1TSHRGAA | |
| SCHEMBL25946273 | 0.80 | EGFR (0.38) | ALDH1A1NPSR1L3MBTL1TSHRGAA | |
| SCHEMBL14204640 | 0.71 | ALDH1A1 (0.41) | ALDH1A1NPSR1L3MBTL1TSHRGAA | |
| SCHEMBL23410062 | 0.71 | EGLN1 (0.53) | ALDH1A1NPSR1L3MBTL1GAAMAPK1 | |
| SCHEMBL29891748 | 0.71 | PTGES (0.42) | ALDH1A1NPSR1L3MBTL1GAANPC1 | |
| SCHEMBL29891577 | 0.71 | EGLN1 (0.53) | ALDH1A1NPSR1L3MBTL1GAAMAPK1 | |
| SCHEMBL23410108 | 0.71 | PTGES (0.42) | ALDH1A1NPSR1L3MBTL1GAANPC1 | |
| SCHEMBL29556288 | 0.70 | GPR3 (0.44) | ALDH1A1NPSR1L3MBTL1TSHRNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4209492-A1 | COMPOUND FOR TREATING THROMBOTIC DISEASES | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2023-07-12 | — | — | EP | disclosed |