Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2466359 | 0.81 | HSP90AA1 (0.39) | CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5829730 | 0.73 | RAPGEF4 (0.39) | CYP1A2KDM4EPTGS1PTGS2RAPGEF4 | |
| SCHEMBL16150477 | 0.72 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL30478860 | 0.71 | PTGS1 (0.39) | CYP1A2KDM4EPTGS1PTGS2ALDH1A1 | |
| SCHEMBL22341337 | 0.70 | PTGS1 (0.38) | KDM4EPTGS1PTGS2ALDH1A1RAB9A | |
| SCHEMBL16151265 | 0.68 | OXER1 (0.41) | CYP1A2CYP3A4CYP2D6KDM4EALDH1A1 | |
| SCHEMBL24485074 | 0.67 | SLC6A2 (0.37) | CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11030528 | 0.65 | ELANE (0.41) | KDM4ERAB9A | |
| SCHEMBL249386 | 0.65 | CA2 (0.63) | ALDH1A1RAB9ASMN1; SMN2 | |
| Benzene SCHEMBL27447210 | 0.65 | CA2 (0.63) | ALDH1A1RAB9ASMN1; SMN2 |
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-2970099-A1 | SUBSTITUTED 3-PHENYLPROPYLAMINE DERIVATIVES FOR THE TREATMENT OF OPHTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014164905-A1 | SUBSTITUTED 3-PHENYLPROPYLAMINE DERIVATIVES FOR THE TREATMENT OF OPHTHALMIC DISEASES AND DISORDERS | ACUCELA INC. (US) | 2014-10-09 | — | — | WO | disclosed |