Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYSLTR1 | Q9Y271 | 4/20 | 0.47 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | PRNP | P04156 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28635314 | 0.83 | CYP1A2 (0.55) | CYP1A2CYSLTR1CYSLTR2KMT2AMEN1 | |
| SCHEMBL4728631 | 0.80 | CYSLTR2 (0.60) | CYP1A2CYSLTR1CYSLTR2KMT2AMEN1 | |
| SCHEMBL28634857 | 0.80 | MEN1 (0.46) | CYP1A2KMT2AMEN1MAPTNPC1 | |
| SCHEMBL11678915 | 0.79 | CYP1A2 (0.51) | CYP1A2CYSLTR1CYSLTR2KMT2AMEN1 | |
| SCHEMBL28547028 | 0.75 | MEN1 (0.49) | KMT2AMEN1MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL140815 | 0.73 | CYP1A2 (0.65) | CYP1A2CYSLTR1CYSLTR2KMT2AMEN1 | |
| Acetic Acid SCHEMBL27459479 | 0.72 | CYP1A2 (0.64) | CYP1A2CYSLTR1CYSLTR2KMT2AMEN1 | |
| SCHEMBL17372711 | 0.72 | CYP1A2 (0.64) | CYP1A2CYSLTR1CYSLTR2KMT2AMEN1 | |
| SCHEMBL4623799 | 0.72 | CYP1A2 (0.68) | CYP1A2CYSLTR1CYSLTR2KMT2AMEN1 | |
| SCHEMBL31442421 | 0.72 | MGAM (0.53) | KMT2AMEN1PRNPMAPTNPC1 |
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-109761986-B | Tricyclic derivative inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2021-10-08 | — | — | CN | disclosed |