Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 14/20 | 0.48 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3284141 | 0.93 | CCR5 (0.42) | CCR5HCRTR1HCRTR2SLC6A1MEN1 | |
| SCHEMBL4689903 | 0.92 | P2RX7 (0.41) | CCR5HPGDSLC6A1MEN1ALDH1A1 | |
| SCHEMBL4691301 | 0.88 | HCRTR1 (0.44) | CCR5HCRTR1HCRTR2 | |
| SCHEMBL4690783 | 0.87 | CCR5 (0.47) | CCR5HCRTR1HCRTR2SLC6A1 | |
| SCHEMBL4694455 | 0.85 | CHRNB2 (0.44) | CCR5HPGDMEN1ALDH1A1KMT2A | |
| SCHEMBL4694264 | 0.84 | ALDH1A1 (0.36) | CCR5HCRTR1HCRTR2SLC6A1ACHE | |
| SCHEMBL4694336 | 0.83 | HCRTR1 (0.36) | CCR5HCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL4691673 | 0.83 | HCRTR1 (0.38) | CCR5HCRTR1HCRTR2 | |
| SCHEMBL4693059 | 0.83 | CCR5 (0.37) | CCR5SLC6A1MEN1ALDH1A1KMT2A | |
| SCHEMBL4690210 | 0.82 | RBP4 (0.35) | CCR5HCRTR1HCRTR2SLC6A1 |
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-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | claimed |
| EP-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |