Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 5/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | SUCNR1 | Q9BXA5 | 2/20 | 0.40 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.39 |
| ▸ | ITGAV | P06756 | 3/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.38 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.38 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.38 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.38 |
| ▸ | ITGB8 | P26012 | 1/20 | 0.38 |
| ▸ | ITGA8 | P53708 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7339949 | 0.93 | ROCK2 (0.44) | ITGB3ITGA2BROCK2ALDH1A1MAPT | |
| SCHEMBL6773670 | 0.92 | ROCK2 (0.43) | ITGB3ITGA2BROCK2ALDH1A1MAPT | |
| SCHEMBL7832728 | 0.91 | ROCK2 (0.42) | ITGB3ITGA2BROCK2ALDH1A1MAPT | |
| SCHEMBL7341019 | 0.90 | ITGB3 (0.46) | ITGB3ITGA2BROCK2ALDH1A1MAPT | |
| SCHEMBL3839471 | 0.90 | GPR139 (0.47) | ITGB3ITGA2BGPR139ITGAVITGB1 | |
| SCHEMBL7832621 | 0.89 | ITGB3 (0.44) | ITGB3ITGA2BROCK2ALDH1A1MAPT | |
| SCHEMBL6772228 | 0.89 | GPR139 (0.43) | ITGB3ITGA2BROCK2ALDH1A1MAPT | |
| SCHEMBL6776653 | 0.88 | ITGB3 (0.58) | ITGB3ITGA2BSUCNR1ITGAVITGB1 | |
| SCHEMBL7340347 | 0.88 | ITGB3 (0.41) | ITGB3ITGA2BROCK2ALDH1A1HPGD | |
| SCHEMBL7341726 | 0.87 | GPR139 (0.42) | ITGB3ALDH1A1GPR139ITGAVITGB1 |
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-0850221-B1 | META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | SEARLE & CO (US) | 2001-07-18 | — | — | EP | claimed |
| EP-0850221-B1 | META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | SEARLE & CO (US) | 2001-07-18 | — | — | EP | disclosed |