Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.37 |
| ▸ | CCR5 | P51681 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 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 | |
|---|---|---|---|---|
| SCHEMBL5232680 | 0.99 | EPHX2 (0.40) | EPHX2RAB9ANPC1HCRTR1HCRTR2 | |
| SCHEMBL5236149 | 0.91 | MAPK1 (0.40) | RAB9AHCRTR1HCRTR2CCR5SIGMAR1 | |
| SCHEMBL5237863 | 0.88 | SIGMAR1 (0.41) | HCRTR1HCRTR2SIGMAR1 | |
| SCHEMBL5236854 | 0.87 | HPGD (0.43) | HCRTR1HCRTR2SIGMAR1SMN1; SMN2NAMPT | |
| SCHEMBL5233648 | 0.87 | HCRTR1 (0.42) | RAB9ANPC1HCRTR1HCRTR2SIGMAR1 | |
| SCHEMBL5233381 | 0.86 | HCRTR1 (0.41) | HCRTR1HCRTR2SIGMAR1 | |
| SCHEMBL5233744 | 0.86 | ALDH1A1 (0.41) | HCRTR1HCRTR2SIGMAR1 | |
| SCHEMBL5237363 | 0.86 | HCRTR1 (0.39) | HCRTR1HCRTR2SIGMAR1 | |
| SCHEMBL5235733 | 0.86 | SIGMAR1 (0.44) | NPC1HCRTR1HCRTR2SIGMAR1SMN1; SMN2 | |
| SCHEMBL5234808 | 0.85 | HCRTR1 (0.38) | RAB9AHCRTR1HCRTR2SIGMAR1POLB |
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-A2 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-03-14 | — | — | EP | claimed |
| WO-2005121145-A2 | OCTAHYDRO-PYRROLO[3,4-C] DERIVATIVES AND THEIR USE AS ANTIVIRAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-12-22 | — | — | WO | claimed |