Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 18/20 | 0.79 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.79 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.79 |
| ▸ | TSHR | P16473 | 2/20 | 0.79 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.79 |
| ▸ | OPRD1 | P41143 | 8/20 | 0.76 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL5631859 | 1.00 | OPRK1 (0.79) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 | |
| SCHEMBL8197783 | 0.89 | OPRK1 (0.73) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 | |
| SCHEMBL8197775 | 0.89 | OPRK1 (0.73) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 | |
| SCHEMBL8061920 | 0.89 | OPRK1 (1.00) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 | |
| SCHEMBL17570381 | 0.89 | OPRK1 (1.00) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 | |
| SCHEMBL8061918 | 0.89 | OPRK1 (1.00) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL29543016 | 0.87 | OPRK1 (0.97) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 | |
| SCHEMBL17570392 | 0.87 | OPRK1 (0.97) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL17105736 | 0.87 | OPRK1 (0.97) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 | |
| SCHEMBL17570405 | 0.87 | OPRK1 (0.97) | OPRK1CYP2D6CYP3A4TSHRCYP2C19 |
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-6133307-A | 2-BENZOFURAN-4-YL-N-(2-(3-HYDROXY-PYRROLIDIN-1-YL)-1-PHENYL-ETHYL) -N-METHYL-ACETAMIDE, FOR EXAMPLE; TREATMENT OF ARTHRITIS, HYPERTENSION, PAIN, INFLAMMATION, MIGRAINE, INFLAMMATORY GASTROINTESTINAL DISORDERS AND PSORIASIS | WARNER-LAMBERT COMPANY (US) | 2000-10-17 | — | — | US | disclosed |
| US-5981513-A | ADMINISTERING ANTI-PRUITIC COMPOUNDS TO PATIENTS | ADOLOR CORPORATION (US) | 1999-11-09 | — | — | US | disclosed |