Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 4/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24263513 | 0.82 | CYP3A4 (0.38) | ALDH1A1MAPTTSHRCYP3A4TDP1 | |
| Hydrochloric Acid SCHEMBL29001918 | 0.81 | CYP3A4 (0.37) | ALDH1A1MAPTTSHRCYP3A4TDP1 | |
| SCHEMBL22123336 | 0.80 | CYP3A4 (0.39) | MAPTTSHRCYP3A4TDP1APEX1 | |
| SCHEMBL14275833 | 0.79 | MAPT (0.38) | ALDH1A1MAPTTSHRCYP3A4TDP1 | |
| SCHEMBL15130648 | 0.79 | MAPT (0.38) | ALDH1A1MAPTTSHRCYP3A4TDP1 | |
| SCHEMBL14655339 | 0.78 | ACE (0.34) | POLBALDH1A1PKMMAPTTSHR | |
| Hydrochloric Acid SCHEMBL2459204 | 0.77 | TSHR (0.41) | ALDH1A1MAPTTSHRCYP3A4TDP1 | |
| Hydrochloric Acid SCHEMBL2459210 | 0.77 | TSHR (0.41) | ALDH1A1MAPTTSHRCYP3A4TDP1 | |
| SCHEMBL6980927 | 0.75 | CYP3A4 (0.38) | MAPTTSHRCYP3A4TDP1APEX1 | |
| SCHEMBL10268571 | 0.75 | MMP1 (0.39) | ALDH1A1MAPTTSHRCYP3A4TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8481541-B2 | Pyrrolopyrazine kinase inhibitors | HOFFMANN-LA ROCHE INC. (US) | 2013-07-09 | — | — | US | claimed |
| US-8481541-B2 | Pyrrolopyrazine kinase inhibitors | HOFFMANN-LA ROCHE INC. (US) | 2013-07-09 | — | — | US | disclosed |