Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 3/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | PTGIR | P43119 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13862448 | 0.92 | TAAR1 (0.45) | MAPK1L3MBTL1TAAR1PPARAPPARG | |
| SCHEMBL29818707 | 0.88 | MAPK1 (0.47) | MAPK1L3MBTL1TAAR1CYP2D6TSHR | |
| SCHEMBL13862311 | 0.86 | CYP2D6 (0.46) | MAPK1L3MBTL1TAAR1PPARAPPARG | |
| SCHEMBL609944 | 0.83 | TAAR1 (0.47) | MAPK1L3MBTL1TAAR1PPARAPPARG | |
| SCHEMBL611955 | 0.83 | TAAR1 (0.44) | MAPK1L3MBTL1TAAR1PPARAPPARG | |
| SCHEMBL3839052 | 0.82 | TAAR1 (0.40) | TAAR1 | |
| SCHEMBL3842123 | 0.81 | TAAR1 (0.39) | MAPK1L3MBTL1TAAR1PPARAPPARG | |
| SCHEMBL612630 | 0.79 | PPARA (0.62) | PPARAPPARGCYP2D6TSHRCNR1 | |
| SCHEMBL610023 | 0.79 | CYP4F2 (0.51) | TAAR1PPARAPPARGCYP2D6KCNH2 | |
| SCHEMBL611119 | 0.78 | TAAR1 (0.45) | MAPK1L3MBTL1TAAR1CYP2D6TSHR |
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 |