Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.54 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.54 |
| ▸ | ITGAV | P06756 | 2/20 | 0.54 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.54 |
| ▸ | ITGB5 | P18084 | 2/20 | 0.54 |
| ▸ | MME | P08473 | 2/20 | 0.49 |
| ▸ | ACE | P12821 | 2/20 | 0.49 |
| ▸ | CPA1 | P15085 | 2/20 | 0.49 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | TACR3 | P29371 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ANPEP | P15144 | 1/20 | 0.44 |
| ▸ | FPR2 | P25090 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7378635 | 1.00 | ALDH1A1 (0.56) | ALDH1A1GAAITGB3ITGB1ITGAV | |
| SCHEMBL3376442 | 0.83 | TACR1 (0.60) | ALDH1A1GAAITGB3ITGA2BACE | |
| SCHEMBL31407351 | 0.83 | TACR1 (0.60) | ALDH1A1GAAITGB3ITGA2BACE | |
| SCHEMBL3376451 | 0.83 | TACR1 (0.60) | ALDH1A1GAAITGB3ITGA2BACE | |
| SCHEMBL7378641 | 0.82 | ALDH1A1 (0.54) | ALDH1A1GAAMMEACECPA1 | |
| SCHEMBL9826152 | 0.82 | LMNA (0.61) | ALDH1A1GAAITGB3ITGA2BMME | |
| SCHEMBL11148829 | 0.81 | MME (0.57) | ITGB3ITGB1ITGAVITGA2BITGB5 | |
| SCHEMBL11148836 | 0.81 | MME (0.54) | ALDH1A1GAAITGB3ITGB1ITGAV | |
| SCHEMBL16203411 | 0.80 | ALDH1A1 (0.56) | ALDH1A1GAAMMEACECPA1 | |
| SCHEMBL3719401 | 0.80 | ACE (0.57) | ITGB3ITGB1ITGAVITGA2BITGB5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0891325-A1 | PARA-SUBSTITUTED PHENYLPROPANOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1999-01-20 | — | — | EP | claimed |
| WO-1997036859-A1 | PARA-SUBSTITUTED PHENYLPROPANOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1997-10-09 | — | — | WO | claimed |