Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 12/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4696109 | 0.91 | KMT2A (0.43) | CCR5LMNATSHR | |
| SCHEMBL4696194 | 0.88 | CCR5 (0.51) | CCR5KCNH2 | |
| SCHEMBL4694509 | 0.88 | CCR5 (0.46) | CCR5KCNH2 | |
| SCHEMBL4694451 | 0.87 | CCR5 (0.45) | CCR5KCNH2CYP2C19 | |
| SCHEMBL4692098 | 0.86 | CCR5 (0.43) | CCR5 | |
| SCHEMBL4692470 | 0.85 | CCR5 (0.40) | CCR5KCNH2 | |
| SCHEMBL4693561 | 0.85 | CCR5 (0.43) | CCR5KCNH2 | |
| SCHEMBL4695160 | 0.85 | CCR5 (0.40) | CCR5KCNH2 | |
| SCHEMBL4696429 | 0.85 | CCR5 (0.41) | CCR5LMNAKCNH2TSHR | |
| SCHEMBL4747316 | 0.85 | CCR5 (0.40) | CCR5KCNH2 |
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 1 patent. 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 |