Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | WDR5 | P61964 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 2/20 | 0.31 |
| ▸ | PPARA | Q07869 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3945050 | 0.81 | TRPV1 (0.51) | TRPV1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL9926 | 0.80 | ALDH1A1 (0.42) | TRPV1ALDH1A1MAPTMAPK1RAB9A | |
| SCHEMBL16546592 | 0.79 | ALDH1A1 (0.40) | ALDH1A1KDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL28986637 | 0.76 | ALDH1A1 (0.37) | TRPV1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL23149109 | 0.75 | ALDH1A1 (0.38) | ALDH1A1KDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL21078838 | 0.74 | HSD17B10 (0.61) | TRPV1ALDH1A1KMT2AMAPK1TSHR | |
| SCHEMBL220074 | 0.73 | MAPT (0.47) | ALDH1A1KDM4EMEN1KMT2AMAPT | |
| SCHEMBL9243983 | 0.73 | ALDH1A1 (0.42) | ALDH1A1KDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL1006518 | 0.73 | ALDH1A1 (0.42) | ALDH1A1KDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL29217709 | 0.73 | THRB (0.35) | ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-111936503-B | Oxazine monoacylglycerol lipase (MAGL) inhibitors | 豪夫迈·罗氏有限公司 | 2023-09-12 | — | — | CN | disclosed |