Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 4/20 | 0.60 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | STS | P08842 | 1/20 | 0.47 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | F2R | P25116 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7303090 | 0.94 | HTT (0.59) | ITGB3ITGA2BHTTRAB9ANPC1 | |
| SCHEMBL7500520 | 0.92 | ITGB3 (0.55) | ITGB3ITGA2BHTTRAB9AALDH1A1 | |
| SCHEMBL22616973 | 0.86 | ALDH1A1 (0.69) | HTTRAB9AALDH1A1NPC1CYP3A4 | |
| SCHEMBL2433449 | 0.85 | USP30 (0.54) | ITGB3ITGA2BHTTKMT2ASTS | |
| SCHEMBL2433452 | 0.85 | USP30 (0.54) | ITGB3ITGA2BHTTKMT2ASTS | |
| SCHEMBL7290589 | 0.84 | CHRM1 (0.51) | ITGB3ITGA2BALDH1A1HPGDKMT2A | |
| SCHEMBL22616979 | 0.84 | GAA (0.67) | RAB9AALDH1A1NPC1CYP3A4CYP2D6 | |
| SCHEMBL22617001 | 0.84 | GAA (0.67) | RAB9AALDH1A1NPC1CYP3A4CYP2D6 | |
| SCHEMBL2263064 | 0.83 | ITGB3 (0.58) | ITGB3ITGA2BHTTRAB9ANPC1 | |
| SCHEMBL2263069 | 0.83 | ITGB3 (0.58) | ITGB3ITGA2BHTTRAB9ANPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0445796-B1 | Derivatives of acetic acid containing peptide bonds | HOFFMANN LA ROCHE (CH) | 1998-06-17 | — | — | EP | disclosed |
| US-5430024-A | Peptides bearing N-terminal amidino moieties and their use as inhibitors of platelet aggregation | HOFFMANN-LA ROCHE INC. (US) | 1995-07-04 | — | — | US | disclosed |
| US-5273982-A | An amidinoaryleneamidoalkylpiperazinyleneacetic acid | HOFFMANN-LA ROCHE INC. (US) | 1993-12-28 | — | — | US | disclosed |
| EP-0445796-A2 | Derivatives of acetic acid | F. HOFFMANN-LA ROCHE AG (CH) | 1991-09-11 | — | — | EP | disclosed |