Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 14/20 | 0.44 |
| ▸ | HCRTR2 | O43614 | 14/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CCR5 | P51681 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4691673 | 0.91 | HCRTR1 (0.38) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4691802 | 0.88 | CCR5 (0.48) | HCRTR1HCRTR2CCR5 | |
| SCHEMBL4691928 | 0.87 | MAPK1 (0.41) | HCRTR1HCRTR2 | |
| SCHEMBL4694455 | 0.85 | CHRNB2 (0.44) | CCR5 | |
| SCHEMBL4690210 | 0.84 | RBP4 (0.35) | HCRTR1HCRTR2CCR5CYP2C9CYP2C19 | |
| SCHEMBL4689903 | 0.83 | P2RX7 (0.41) | HTTCCR5LMNACYP2C9CYP2C19 | |
| SCHEMBL4694309 | 0.83 | HCRTR1 (0.39) | HCRTR1HCRTR2 | |
| SCHEMBL4691783 | 0.82 | HCRTR1 (0.41) | HCRTR1HCRTR2CCR5CYP1A2 | |
| SCHEMBL4693059 | 0.81 | CCR5 (0.37) | CCR5 |
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 |