Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAU | P00749 | 1/20 | 0.56 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CRHBP | P24387 | 2/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ANPEP | P15144 | 2/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6941 | 0.87 | PLAU (0.68) | PLAUIDO1SIGMAR1ANPEPFYN | |
| SCHEMBL29365759 | 0.87 | PLAU (0.68) | PLAUIDO1SIGMAR1ANPEPFYN | |
| Hydrochloric Acid SCHEMBL29384401 | 0.85 | PLAU (0.65) | PLAUIDO1SIGMAR1ANPEPFYN | |
| Hydrochloric Acid SCHEMBL151479 | 0.85 | PLAU (0.65) | PLAUIDO1SIGMAR1ANPEPFYN | |
| Hydrochloric Acid SCHEMBL4543313 | 0.82 | PLAU (0.62) | PLAUIDO1SIGMAR1ANPEPFYN | |
| SCHEMBL20402534 | 0.75 | PLAU (0.54) | PLAUIDO1SIGMAR1FYNHTR2A | |
| Dioxane SCHEMBL3940644 | 0.74 | ANPEP (0.41) | PLAUIDO1LMNACRHBPCRHR2 | |
| Hydrochloric Acid SCHEMBL10460312 | 0.73 | MAOA (0.54) | PLAUIDO1SIGMAR1LMNASMN1; SMN2 | |
| Azobenzene SCHEMBL26642269 | 0.73 | ALDH1A1 (0.52) | PLAUIDO1SIGMAR1HTTANPEP | |
| Azobenzene SCHEMBL26642263 | 0.73 | ALDH1A1 (0.52) | PLAUIDO1SIGMAR1HTTANPEP |
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 |
|---|---|---|---|---|---|---|---|
| EP-2049481-A2 | NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS FOR OPIOID RECEPTORS | SmithKline Beecham Corporation (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008021851-A2 | NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS FOR OPIOID RECEPTORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-02-21 | — | — | WO | disclosed |