Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.48 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3837471 | 0.88 | HRH3 (0.56) | GRM5HRH3CYP2D6DRD2DRD3 | |
| SCHEMBL3841194 | 0.87 | FFAR1 (0.44) | FFAR1FFAR4HRH3CYP2D6DRD2 | |
| SCHEMBL3843367 | 0.85 | HRH3 (0.47) | FFAR1FFAR4HRH3CYP2D6KCNH2 | |
| SCHEMBL3836802 | 0.84 | PTGES (0.50) | FFAR1HRH3CYP2D6DRD2OPRM1 | |
| SCHEMBL233921 | 0.81 | MAOA (0.49) | GRM5FFAR1FFAR4 | |
| SCHEMBL5249356 | 0.80 | FFAR1 (0.66) | GRM5FFAR1FFAR4HRH3DRD2 | |
| Hydrochloric Acid SCHEMBL611627 | 0.80 | MAOA (0.47) | GRM5FFAR1FFAR4 | |
| SCHEMBL3837565 | 0.79 | PTGES (0.46) | GRM5FFAR1HRH3CYP2D6DRD2 | |
| SCHEMBL13335290 | 0.78 | FFAR1 (0.56) | GRM5FFAR1FFAR4EGFRPTGES | |
| SCHEMBL3842200 | 0.78 | HRH3 (0.41) | FFAR1FFAR4HRH3CYP2D6EGFR |
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-2111223-A1 | AMINE DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2009-10-28 | — | — | EP | disclosed |
| WO-2009058216-A1 | AMINE DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | ACUCELA, INC. (US) | 2009-05-07 | — | — | WO | disclosed |