Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 6/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200767 | 0.93 | LDHA (0.42) | — | |
| SCHEMBL14200830 | 0.89 | LDHA (0.44) | — | |
| SCHEMBL14200763 | 0.88 | SIGMAR1 (0.42) | EPHX2LTA4H | |
| SCHEMBL14229886 | 0.87 | EPHX2 (0.49) | EPHX2LTA4HCYP3A4CYP2C8CYP2C9 | |
| SCHEMBL14229730 | 0.86 | EPHX2 (0.46) | EPHX2LTA4HCYP3A4CYP2C8CYP2C9 | |
| SCHEMBL14200831 | 0.85 | LDHA (0.43) | — | |
| SCHEMBL14200776 | 0.84 | NPC1 (0.35) | CYP3A4TRPV1 | |
| SCHEMBL14200833 | 0.83 | EPHX2 (0.45) | EPHX2 | |
| SCHEMBL14200792 | 0.82 | RIPK1 (0.45) | TRPV1 | |
| SCHEMBL14200900 | 0.82 | PSEN1 (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 |