Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.60 |
| ▸ | HTR2A | P28223 | 2/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12378777 | 1.00 | TAAR1 (0.60) | TAAR1HTR2AALOX5MAOAPYCR1 | |
| SCHEMBL175157 | 1.00 | TAAR1 (0.60) | TAAR1HTR2AALOX5MAOAPYCR1 | |
| Hydrochloric Acid SCHEMBL5877710 | 0.98 | TAAR1 (0.58) | TAAR1HTR2AALOX5MAOAPYCR1 | |
| Hydrochloric Acid SCHEMBL5877704 | 0.98 | TAAR1 (0.58) | TAAR1HTR2AALOX5MAOAPYCR1 | |
| Hydrochloric Acid SCHEMBL5877780 | 0.98 | TAAR1 (0.58) | TAAR1HTR2AALOX5MAOAPYCR1 | |
| SCHEMBL3006604 | 0.87 | TAAR1 (0.75) | TAAR1HTR2AALDH1A1ALOX15 | |
| Hydrochloric Acid SCHEMBL6564727 | 0.85 | TAAR1 (0.71) | TAAR1HTR2AALOX15 | |
| SCHEMBL14966455 | 0.82 | HTR2A (0.45) | TAAR1HTR2AALOX5MAOAPYCR1 | |
| SCHEMBL10456468 | 0.78 | PYCR1 (0.41) | HTR2AALOX5MAOAPYCR1CYP2A6 | |
| SCHEMBL14221288 | 0.78 | ALDH1A1 (0.44) | HTR2AALOX5PYCR1CYP2A6ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018140876-A1 | NRF2 ACTIVATOR | BIOGEN MA INC. (US) | 2018-08-02 | — | — | WO | disclosed |