Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | CTSS | P25774 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 2/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | SLC6A5 | Q9Y345 | 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 | |
|---|---|---|---|---|
| SCHEMBL3991791 | 0.99 | ALDH1A1 (0.46) | SIGMAR1ALDH1A1CTSLCTSBCTSS | |
| SCHEMBL19031238 | 0.96 | ALDH1A1 (0.46) | SIGMAR1ALDH1A1MAPTHPGDMAPK1 | |
| SCHEMBL20582129 | 0.93 | ALDH1A1 (0.49) | SIGMAR1ALDH1A1MAPTHPGDMAPK1 | |
| SCHEMBL6247144 | 0.89 | SIGMAR1 (0.44) | SIGMAR1ALDH1A1CTSLCTSBCTSS | |
| SCHEMBL2746329 | 0.86 | RORC (0.43) | SIGMAR1ALDH1A1MAPTHPGDMAPK1 | |
| SCHEMBL3989543 | 0.84 | ALDH1A1 (0.46) | SIGMAR1ALDH1A1CTSLCTSBCTSS | |
| SCHEMBL3991794 | 0.82 | ALDH1A1 (0.47) | SIGMAR1ALDH1A1CTSLCTSBCTSS | |
| SCHEMBL18765832 | 0.81 | ALDH1A1 (0.49) | SIGMAR1ALDH1A1MAPTHPGDMAPK1 | |
| SCHEMBL1189285 | 0.81 | ABCB1 (0.45) | SIGMAR1ALDH1A1MAPTHPGDRORC | |
| SCHEMBL14847457 | 0.80 | L3MBTL1 (0.41) | SIGMAR1ALDH1A1CTSLCTSBCTSS |
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 |
|---|---|---|---|---|---|---|---|
| US-7553969-B1 | Substituted phenethylamine derivatives | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2009-06-30 | — | — | US | disclosed |
| EP-1149843-A1 | SUBSTITUTED PHENETHYLAMINE DERIVATIVES | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2001-10-31 | — | — | EP | disclosed |