Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.38 |
| ▸ | UGCG | Q16739 | 1/20 | 0.38 |
| ▸ | GBA2 | Q9HCG7 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14101264 | 0.86 | LOXL2 (0.42) | HRH3HRH4GBA1UGCGGBA2 | |
| SCHEMBL12743775 | 0.82 | HRH1 (0.52) | HRH3HRH4GBA1UGCGGBA2 | |
| SCHEMBL17132267 | 0.81 | LOXL2 (0.46) | HRH3HRH4CYP17A1CYP19A1KDM4E | |
| SCHEMBL12743794 | 0.80 | HRH1 (0.48) | HRH3HRH4LOXL2TDP1L3MBTL1 | |
| SCHEMBL96048 | 0.80 | TSHR (0.56) | HRH3HRH4KMT2ATDP1L3MBTL1 | |
| SCHEMBL13610216 | 0.79 | CYP3A4 (0.44) | GBA1UGCGGBA2KDM4EKMT2A | |
| SCHEMBL96808 | 0.78 | L3MBTL1 (0.54) | HRH3HRH4GBA1UGCGGBA2 | |
| SCHEMBL97794 | 0.78 | L3MBTL1 (0.54) | HRH3HRH4GBA1UGCGGBA2 | |
| SCHEMBL2569768 | 0.78 | HRH1 (0.52) | HRH3HRH4GBA1UGCGGBA2 | |
| Butane SCHEMBL29206935 | 0.78 | LMNA (0.43) | GBA1UGCGGBA2KDM4EKMT2A |
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-5659065-A | CHEMICAL INTERMEDIATES FOR MEDICINAL ACTIVE AGENTS | NOVARTIS CORPORATION (US) | 1997-08-19 | — | — | US | disclosed |
| EP-0678500-A1 | Alpha-amino alkanoic acids and reduction products as intermediates in the preparation of renin inhibitors | CIBA-GEIGY AG (CH) | 1995-10-25 | — | — | EP | disclosed |