Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3281859 | 0.88 | CCR5 (0.52) | CCR5TP53LMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL4694331 | 0.86 | TP53 (0.47) | TP53LMNAALDH1A1GLAMAPT | |
| SCHEMBL4690401 | 0.86 | TP53 (0.47) | TP53LMNAALDH1A1GLAMAPT | |
| SCHEMBL4691648 | 0.85 | TP53 (0.43) | CCR5TP53LMNAALDH1A1GLA | |
| SCHEMBL3282221 | 0.84 | CCR5 (0.51) | CCR5TP53LMNAALDH1A1GLA | |
| SCHEMBL4694785 | 0.83 | KMT2A (0.48) | TP53LMNAALDH1A1MAPTKMT2A | |
| SCHEMBL3283591 | 0.83 | CCL5 (0.51) | CCR5 | |
| SCHEMBL4694813 | 0.83 | CYP1A2 (0.48) | CCR5TP53LMNAALDH1A1MAPT | |
| SCHEMBL4692756 | 0.83 | KMT2A (0.44) | TP53LMNAALDH1A1GLAMAPT | |
| SCHEMBL4695960 | 0.83 | ALDH1A1 (0.46) | TP53LMNAALDH1A1GLAMAPT |
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 |