Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CETP | P11597 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4529913 | 0.92 | OPRM1 (0.58) | OPRM1TP53SPHK1TRPV1TRPA1 | |
| SCHEMBL4531321 | 0.92 | OPRM1 (0.50) | OPRM1TP53SPHK1ALDH1A1TDP1 | |
| SCHEMBL4532743 | 0.84 | OPRM1 (0.41) | OPRM1TP53SPHK1TRPV1TRPA1 | |
| SCHEMBL4530850 | 0.79 | OPRM1 (0.48) | OPRM1TP53SPHK1TRPV1TRPA1 | |
| SCHEMBL4525282 | 0.79 | OPRM1 (0.48) | OPRM1TP53SPHK1TRPV1TRPA1 | |
| SCHEMBL4514700 | 0.78 | S1PR2 (0.47) | OPRM1TP53SPHK1ALDH1A1CYP2D6 | |
| SCHEMBL4522713 | 0.76 | S1PR2 (0.50) | OPRM1TP53SPHK1ALDH1A1CYP2D6 | |
| SCHEMBL4525739 | 0.76 | S1PR2 (0.50) | OPRM1TP53SPHK1ALDH1A1CYP2D6 | |
| SCHEMBL4526000 | 0.75 | OPRM1 (0.39) | OPRM1TP53TRPV1TRPA1ALDH1A1 | |
| SCHEMBL4513305 | 0.74 | DNM1 (0.48) | ALDH1A1LMNABLM |
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-7507480-B2 | Corrosion-resistant metal surfaces | BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) | 2009-03-24 | — | — | US | disclosed |
| US-20060269760-A1 | Corrosion-resistant metal surfaces | ENERGY, UNITED STATES DEPARTMENT OF | 2006-11-30 | — | — | US | disclosed |