Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 9/20 | 0.67 |
| ▸ | CCL5 | P13501 | 11/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4691646 | 0.89 | LMNA (0.59) | CCR5CCL5USP2ALDH1A1TSHR | |
| Cyclopentane SCHEMBL4696753 | 0.85 | CCR5 (0.83) | CCR5 | |
| SCHEMBL4694462 | 0.85 | ALDH1A1 (0.60) | CCR5MEN1USP2ALDH1A1TSHR | |
| SCHEMBL3290294 | 0.84 | CCL5 (0.69) | CCR5CCL5 | |
| SCHEMBL4691442 | 0.84 | CCL5 (0.56) | CCR5CCL5 | |
| SCHEMBL3282169 | 0.84 | CCL5 (0.69) | CCR5CCL5 | |
| SCHEMBL3285413 | 0.83 | CCR5 (0.70) | CCR5CCL5 | |
| SCHEMBL3290682 | 0.83 | CCR5 (0.70) | CCR5CCL5 | |
| SCHEMBL13359853 | 0.82 | CCL5 (0.54) | CCR5CCL5 | |
| SCHEMBL4694909 | 0.82 | CCL5 (0.58) | CCR5CCL5 |
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 |