Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ALDH1A3 | P47895 | 6/20 | 0.42 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27308881 | 0.90 | PTGER3 (0.44) | ALDH1A1HSD17B10TDP1ALDH1A3ALDH3A1 | |
| SCHEMBL20615329 | 0.85 | NR3C1 (0.39) | ALDH1A1NR3C1PGRARKMT2A | |
| SCHEMBL11142403 | 0.83 | ALDH1A3 (0.43) | ALDH1A1HSD17B10TDP1ALDH1A3ALDH3A1 | |
| SCHEMBL11135728 | 0.81 | SCN9A (0.49) | ALDH1A1HSD17B10TDP1ALDH1A3ALDH3A1 | |
| SCHEMBL11143363 | 0.81 | ALDH1A1 (0.39) | ALDH1A1HSD17B10TDP1ALDH1A3ALDH3A1 | |
| SCHEMBL30186040 | 0.80 | ALDH1A1 (0.53) | ALDH1A1HSD17B10TDP1ALDH1A3ALDH3A1 | |
| SCHEMBL1418463 | 0.80 | ALDH1A1 (0.53) | ALDH1A1HSD17B10TDP1ALDH1A3ALDH3A1 | |
| SCHEMBL8521711 | 0.79 | ALDH1A3 (0.43) | ALDH1A1HSD17B10TDP1ALDH1A3ALDH3A1 | |
| SCHEMBL13180252 | 0.78 | NR3C1 (0.42) | ALDH1A1HSD17B10NR3C1PGRAR | |
| SCHEMBL24826392 | 0.77 | NR3C1 (0.44) | ALDH1A1NR3C1PGRARHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-4403095-A | DYEING POLYACRYLONITRILES | CIBA-GEIGY CORPORATION (US) | 1983-09-06 | — | — | US | disclosed |