Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 7/20 | 0.45 |
| ▸ | DRD4 | P21917 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL14200379 | 0.87 | MTNR1A (0.50) | PKMMEN1KMT2A | |
| SCHEMBL24201848 | 0.86 | DRD2 (0.53) | NOTUMPKMDRD2DRD4ALDH1A1 | |
| SCHEMBL14229140 | 0.85 | NOTUM (0.50) | NOTUMPKMDRD2DRD4ALDH1A1 | |
| SCHEMBL7593171 | 0.74 | NOTUM (0.57) | NOTUMPKMDRD2DRD4ALDH1A1 | |
| SCHEMBL7067724 | 0.74 | MTNR1A (0.43) | PKMALDH1A1MEN1KMT2A | |
| SCHEMBL5556232 | 0.73 | PKM (0.51) | NOTUMPKMALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL18701883 | 0.72 | DRD2 (0.51) | NOTUMPKMDRD2DRD4ALDH1A1 | |
| SCHEMBL14229139 | 0.72 | MTNR1A (0.48) | PKM | |
| SCHEMBL14200385 | 0.71 | MTNR1A (0.43) | NOTUMALDH1A1CYP1A2CYP2C19NPC1 | |
| SCHEMBL27968682 | 0.70 | NOTUM (0.52) | NOTUMPKMDRD2DRD4ALDH1A1 |
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 3 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 |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |