Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CCR5 | P51681 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.35 |
| ▸ | RBP4 | P02753 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4694116 | 0.86 | HCRTR2 (0.38) | CCR5HCRTR1HCRTR2CHRNB2CHRNB4 | |
| SCHEMBL4694255 | 0.85 | NAMPT (0.43) | CCR5MAPTKMT2AMEN1CHRNB2 | |
| SCHEMBL4693258 | 0.83 | HCRTR1 (0.41) | LMNACCR5HCRTR1HCRTR2CYP2C9 | |
| SCHEMBL4693757 | 0.82 | LMNA (0.39) | LMNACCR5HCRTR1HCRTR2RBP4 | |
| SCHEMBL4690347 | 0.82 | HCRTR2 (0.42) | CCR5HCRTR1HCRTR2 | |
| SCHEMBL4694094 | 0.81 | CHRNB2 (0.44) | CCR5SMN1; SMN2L3MBTL1CHRNB2CHRNB4 | |
| SCHEMBL4695377 | 0.80 | CCR5 (0.37) | CCR5CYP2C9CYP2C19TSHRCHRNB2 | |
| SCHEMBL4691741 | 0.80 | HCRTR2 (0.36) | CCR5HCRTR1HCRTR2 | |
| SCHEMBL4692504 | 0.80 | HCRTR1 (0.44) | LMNACCR5KDM4EHCRTR1HCRTR2 | |
| SCHEMBL4694315 | 0.80 | HCRTR2 (0.41) | HCRTR1HCRTR2KMT2A |
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 |