Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 5/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 4/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 4/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | C1S | P09871 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL626635 | 0.81 | MAOA (0.44) | MAOAMAOBKDM1A | |
| Hydrochloric Acid SCHEMBL4604224 | 0.79 | MAOA (0.42) | MAOAMAOBKDM1A | |
| Hydrochloric Acid SCHEMBL30361381 | 0.79 | MAOA (0.42) | MAOAMAOBKDM1A | |
| SCHEMBL28321113 | 0.79 | MAOA (0.42) | MAOAMAOBKDM1A | |
| Hydrochloric Acid SCHEMBL4604472 | 0.79 | MAOA (0.42) | MAOAMAOBKDM1A | |
| Formic Acid SCHEMBL4745804 | 0.78 | MAOA (0.44) | MAOAMAOBMTNR1AMTNR1BKDM1A | |
| Aniline SCHEMBL3769652 | 0.71 | TSHR (0.55) | CES1C1S | |
| SCHEMBL26024929 | 0.70 | MAOA (0.66) | MAOAMAOBCES1MTNR1AMTNR1B | |
| Trifluoroacetic Acid SCHEMBL1788968 | 0.69 | PLAU (0.47) | CES1DPP7KDM1A | |
| Trifluoroacetic Acid SCHEMBL4782632 | 0.68 | PNMT (0.43) | MAOBCES1KDM1A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106572658-B | Molecule and relative intermediate, composition and method with certain disinsection efficiencies | 美国陶氏益农公司 | 2019-11-08 | — | — | CN | disclosed |
| CN-106572658-A | Molecules having certain pesticidal utilities, and intermediates, compositions, and processes related thereto | 美国陶氏益农公司 | 2017-04-19 | — | — | CN | disclosed |
| EP-2049481-A2 | NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS FOR OPIOID RECEPTORS | SmithKline Beecham Corporation (US) | 2009-04-22 | — | — | EP | disclosed |
| EP-1943226-A2 | PHENOL ETHERS AS MODULATORS OF THE OPIOID RECEPTORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2008021851-A2 | NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS FOR OPIOID RECEPTORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-02-21 | — | — | WO | disclosed |
| WO-2007047397-A2 | PHENOL ETHERS AS MODULATORS OF THE OPIOID RECEPTORS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-04-26 | — | — | WO | disclosed |