Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | HTR6 | P50406 | 10/20 | 0.42 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.40 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 4/20 | 0.38 |
| ▸ | HTR1A | P08908 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5280569 | 0.81 | HTR6 (0.50) | MEN1KMT2AHTR6ALDH1A1HTT | |
| SCHEMBL6798179 | 0.77 | MBTD1 (0.59) | MEN1KMT2AHTR6MBTD1L3MBTL3 | |
| SCHEMBL4251866 | 0.71 | PLCG1 (0.56) | MEN1KMT2AL3MBTL1MBTD1L3MBTL3 | |
| SCHEMBL8557186 | 0.71 | CHRM1 (0.49) | KMT2AHTR6MBTD1L3MBTL3CTSL | |
| SCHEMBL532807 | 0.70 | TDP1 (0.70) | MEN1KMT2AMBTD1L3MBTL3ALDH1A1 | |
| SCHEMBL99072 | 0.70 | PSIP1 (0.56) | MEN1KMT2AALDH1A1 | |
| SCHEMBL4270620 | 0.70 | L3MBTL1 (0.63) | MEN1KMT2AL3MBTL1HTR6MBTD1 | |
| SCHEMBL6726327 | 0.69 | ATM (0.45) | MEN1KMT2AL3MBTL1MBTD1L3MBTL3 | |
| SCHEMBL3600024 | 0.69 | ATM (0.49) | MEN1KMT2AL3MBTL1MBTD1L3MBTL3 | |
| SCHEMBL17364184 | 0.69 | ATM (0.45) | MEN1KMT2AL3MBTL1MBTD1L3MBTL3 |
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-104903300-B | COMT inhibitor | 霍夫曼-拉罗奇有限公司 | 2018-04-17 | — | — | CN | disclosed |