Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | CSF3R | Q99062 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | EPOR | P19235 | 1/20 | 0.40 |
| ▸ | PTGIR | P43119 | 1/20 | 0.40 |
| ▸ | GGPS1 | O95749 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2207505 | 0.86 | CSF3R (0.48) | TAAR1CYP2D6CSF3RMAPK1L3MBTL1 | |
| SCHEMBL3967112 | 0.84 | TAAR1 (0.47) | TAAR1MAPK1L3MBTL1TSHRTDP1 | |
| SCHEMBL611250 | 0.84 | TAAR1 (0.42) | TAAR1CYP2D6 | |
| SCHEMBL4569094 | 0.81 | TAAR1 (0.51) | TAAR1CYP2D6PPARGPPARATSHR | |
| SCHEMBL19291600 | 0.81 | CYP2D6 (0.55) | TAAR1CYP2D6PPARGPPARATSHR | |
| SCHEMBL2204526 | 0.81 | CYP4F2 (0.51) | TAAR1CYP2D6PPARGPPARAACHE | |
| SCHEMBL2206860 | 0.81 | CYP4F2 (0.51) | TAAR1CYP2D6PPARGPPARAACHE | |
| SCHEMBL29818682 | 0.81 | CYP4F2 (0.51) | TAAR1CYP2D6PPARGPPARAACHE | |
| SCHEMBL2204738 | 0.81 | TAAR1 (0.45) | TAAR1CYP2D6MAPK1PPARGPPARA | |
| SCHEMBL3972481 | 0.81 | TAAR1 (0.45) | TAAR1CYP2D6MAPK1PPARGPPARA |
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-2091955-A1 | ALKOXY COMPOUNDS FOR DISEASE TREATMENT | Acucela, Inc. (US) | 2009-08-26 | — | — | EP | disclosed |
| WO-2009045479-A1 | ALKOXY COMPOUNDS FOR DISEASE TREATMENT | ACUCELA INC. (US) | 2009-04-09 | — | — | WO | disclosed |