Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CCR5 | P51681 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CCL5 | P13501 | 5/20 | 0.41 |
| ▸ | KDM2B | Q8NHM5 | 2/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4691220 | 0.86 | DPP4 (0.50) | CCR5HCRTR1HCRTR2DPP4CCL5 | |
| SCHEMBL4691767 | 0.81 | CHRNB2 (0.54) | CCR5CCL5 | |
| SCHEMBL4694458 | 0.81 | CCR5 (0.53) | CCR5CCL5 | |
| SCHEMBL4689730 | 0.81 | DPP4 (0.51) | CCR5DPP4CCL5KDM2BMGAM | |
| SCHEMBL4690162 | 0.80 | SMN1; SMN2 (0.49) | CCR5SMN1; SMN2CCL5 | |
| SCHEMBL4694682 | 0.79 | CCR5 (0.46) | CCR5CCL5 | |
| SCHEMBL4695170 | 0.79 | CYP2D6 (0.47) | TSHRCCR5MEN1KMT2AMAPK1 | |
| SCHEMBL5237603 | 0.78 | TSHR (0.46) | GRIN2BTSHRMEN1KMT2AHCRTR1 | |
| SCHEMBL4691442 | 0.77 | CCL5 (0.56) | CCR5CCL5 | |
| SCHEMBL4694209 | 0.77 | CCR5 (0.43) | CCR5HCRTR1HCRTR2CCL5 |
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 |