Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | REN | P00797 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL3861234 | 0.83 | PNMT (0.36) | CYP2A6TAAR1DRD2MAOATRPA1 | |
| SCHEMBL3173093 | 0.81 | TAAR1 (0.42) | CYP2A6TAAR1DRD2DRD1MAOA | |
| SCHEMBL3837370 | 0.77 | TAAR1 (0.41) | TAAR1MAOA | |
| SCHEMBL4073253 | 0.77 | TAAR1 (0.44) | CYP2A6TAAR1DRD2DRD1MAOA | |
| SCHEMBL3839426 | 0.77 | TAAR1 (0.42) | CYP2A6TAAR1DRD2DRD1MAOA | |
| SCHEMBL3843593 | 0.76 | HTR6 (0.35) | CYP2A6TAAR1DRD2DRD1MAOA | |
| SCHEMBL933101 | 0.75 | TRPA1 (0.56) | CYP2A6TAAR1MAOATRPA1CYP2D6 | |
| SCHEMBL3840901 | 0.75 | HTR6 (0.34) | CYP2A6TAAR1DRD2DRD1MAOA | |
| SCHEMBL7823900 | 0.74 | TAAR1 (0.58) | TAAR1 | |
| SCHEMBL611250 | 0.74 | TAAR1 (0.42) | CYP2A6TAAR1DRD2DRD1MAOA |
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 4 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 |
| EP-2076122-A2 | ALKYNYL PHENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2009-07-08 | — | — | EP | disclosed |
| WO-2009058216-A1 | AMINE DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | ACUCELA, INC. (US) | 2009-05-07 | — | — | WO | disclosed |
| WO-2009005794-A2 | ALKYNYL PHENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | ACUCELA, INC. (US) | 2009-01-08 | — | — | WO | disclosed |