Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | LAP3 | P28838 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20436626 | 0.85 | TRPA1 (0.38) | TAAR1SLC6A2CYP2A6MAOASLC6A4 | |
| SCHEMBL8072983 | 0.85 | TAAR1 (0.33) | ALDH1A1TAAR1SLC6A2CYP2A6MAOA | |
| SCHEMBL24111210 | 0.78 | LTA4H (0.46) | CYP1A2 | |
| SCHEMBL388942 | 0.78 | EPHX1 (0.48) | TAAR1SLC6A2CYP2A6MAOASLC6A4 | |
| SCHEMBL13594158 | 0.77 | SIGMAR1 (0.44) | TAAR1SLC6A2CYP2A6MAOASLC6A4 | |
| SCHEMBL24111209 | 0.75 | CYP1A2 (0.37) | CYP1A2 | |
| SCHEMBL12569402 | 0.75 | ALDH1A1 (0.53) | ALDH1A1TAAR1SLC6A2CYP2A6MAOA | |
| SCHEMBL17754425 | 0.75 | CYP2D6 (0.45) | TAAR1SLC6A2CYP2A6MAOASLC6A4 | |
| SCHEMBL11233017 | 0.75 | ALDH1A1 (0.47) | ALDH1A1TAAR1SLC6A2CYP2A6MAOA | |
| SCHEMBL10771862 | 0.74 | CTSS (0.43) | ALDH1A1SMN1; 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-3160966-A1 | MNK INHIBITORS AND METHODS RELATED THERETO | Effector Therapeutics Inc. (US) | 2017-05-03 | — | — | EP | disclosed |
| WO-2015200481-A1 | MNK INHIBITORS AND METHODS RELATED THERETO | EFFECTOR THERAPEUTICS, INC. (US) | 2015-12-30 | — | — | WO | disclosed |