Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 19/20 | 0.60 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.50 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.50 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.50 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5422985 | 0.90 | CCR5 (0.68) | CCR5 | |
| Cyclopentane SCHEMBL4696541 | 0.83 | CCR5 (0.69) | CCR5 | |
| SCHEMBL3283162 | 0.83 | CHRNB2 (0.54) | CCR5CHRNB2CHRNB4CHRNA3CHRNA7 | |
| Cyclopentane SCHEMBL4695120 | 0.82 | CCR5 (0.63) | CCR5 | |
| Cyclopentane SCHEMBL4691110 | 0.82 | CCR5 (0.64) | CCR5 | |
| Cyclopentane SCHEMBL4697136 | 0.81 | CCR5 (0.59) | CCR5 | |
| SCHEMBL4694961 | 0.81 | CCR5 (0.72) | CCR5 | |
| SCHEMBL4694960 | 0.81 | CCR5 (0.72) | CCR5 | |
| Cyclopentane SCHEMBL4694862 | 0.80 | CCR5 (0.65) | CCR5 | |
| Cyclopentane SCHEMBL4695484 | 0.80 | CCR5 (0.78) | 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 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 |