Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 8/20 | 0.48 |
| ▸ | ATM | Q13315 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.45 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22267933 | 0.76 | HRH4 (0.42) | HRH3HRH4TMEM97SIGMAR1HIF1A | |
| SCHEMBL6263999 | 0.75 | — | — | |
| SCHEMBL29403584 | 0.74 | ATM (0.57) | TAAR1ATMMEN1KMT2AALOX15 | |
| SCHEMBL883731 | 0.74 | ATM (0.57) | TAAR1ATMMEN1KMT2AALOX15 | |
| SCHEMBL12831165 | 0.73 | MAPT (0.40) | TAAR1ATMMAPTALDH1A1HRH3 | |
| SCHEMBL7547843 | 0.73 | CHRNB2 (0.39) | MAPTALDH1A1HRH3MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL3544868 | 0.73 | ATM (0.55) | TAAR1ATMCYP1A2L3MBTL1 | |
| SCHEMBL19049448 | 0.73 | KDM4E (0.55) | MAPTALDH1A1ALOX15CYP1A2TSHR | |
| SCHEMBL5660332 | 0.72 | — | — | |
| SCHEMBL408922 | 0.71 | TAAR1 (0.60) | TAAR1ATMMAPTALDH1A1HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019118583-A1 | HALOGENATED DERIVATIVES OF MORPHINANS AND USES THEREOF | XALUD THERAPEUTICS, INC. (US) | 2019-06-20 | — | — | WO | disclosed |
| WO-2017134547-A1 | TUBULYSIN ANALOGS AND METHODS FOR THEIR PREPARATION | PFIZER INC. (US) | 2017-08-10 | — | — | WO | disclosed |