Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 2/20 | 0.31 |
| ▸ | PER2 | O15055 | 1/20 | 0.31 |
| ▸ | CRY1 | Q16526 | 1/20 | 0.31 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | MMP1 | P03956 | 1/20 | 0.30 |
| ▸ | MMP2 | P08253 | 1/20 | 0.30 |
| ▸ | MMP8 | P22894 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19766998 | 0.89 | PIK3CD (0.42) | PIK3CDPER2CRY1CRY2 | |
| SCHEMBL14229345 | 0.88 | TP53 (0.36) | MMP3TP53MMP1MMP2MMP8 | |
| SCHEMBL14229451 | 0.84 | CA1 (0.43) | TP53 | |
| SCHEMBL14230123 | 0.84 | PIK3CD (0.37) | PIK3CDCYP1A2CYP3A4CYP2C9PKM | |
| SCHEMBL25456874 | 0.83 | PIK3CD (0.37) | PIK3CD | |
| SCHEMBL14229149 | 0.81 | BMP1 (0.41) | CYP1A2CYP3A4CYP2C9PKMCYP2C19 | |
| SCHEMBL14229525 | 0.79 | CNR2 (0.38) | CYP1A2CYP3A4CYP2C9PKMCYP2C19 | |
| SCHEMBL14229124 | 0.79 | MMP3 (0.36) | MMP3TP53 | |
| SCHEMBL14200421 | 0.79 | PIK3CD (0.34) | PIK3CD | |
| SCHEMBL14229340 | 0.78 | CNR2 (0.40) | — |
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-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |