Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 12/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4693818 | 0.91 | CCR5 (0.51) | CCR5LMNAHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL4694947 | 0.82 | CCL5 (0.48) | CCR5 | |
| SCHEMBL4692633 | 0.78 | CCR5 (0.67) | CCR5SMN1; SMN2ALDH1A1 | |
| SCHEMBL4693043 | 0.74 | CCR5 (0.56) | CCR5SMN1; SMN2MAPT | |
| SCHEMBL4694000 | 0.74 | CCR5 (0.57) | CCR5 | |
| SCHEMBL4691691 | 0.74 | CCR5 (0.51) | CCR5LMNAHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL4694606 | 0.72 | CCR5 (0.49) | CCR5 | |
| SCHEMBL4972691 | 0.72 | CCL5 (0.55) | CCR5 | |
| SCHEMBL4695602 | 0.71 | CCR5 (0.52) | CCR5 | |
| SCHEMBL13326684 | 0.71 | CCR5 (0.69) | 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 |