Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.44 |
| ▸ | BRAF | P15056 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | RAF1 | P04049 | 2/20 | 0.43 |
| ▸ | PTGDR | Q13258 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 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 | |
|---|---|---|---|---|
| SCHEMBL28267602 | 0.89 | HRH4 (0.47) | ALDH1A1HRH4BRAFSMN1; SMN2 | |
| SCHEMBL28151179 | 0.84 | HRH4 (0.51) | MAPTHRH4SMN1; SMN2PTGDRPOLB | |
| SCHEMBL28265781 | 0.82 | ALDH1A1 (0.46) | ALDH1A1MAPTHRH4SMN1; SMN2MAPK8 | |
| SCHEMBL28265753 | 0.82 | TLR8 (0.46) | ALDH1A1HRH4SMN1; SMN2 | |
| SCHEMBL15757787 | 0.82 | NUDT1 (0.51) | ALDH1A1PKMLMNAMAPTMAPK14 | |
| SCHEMBL28265690 | 0.82 | MAPT (0.45) | ALDH1A1PKMLMNAMAPTMAPK14 | |
| SCHEMBL28267598 | 0.81 | TLR8 (0.55) | ALDH1A1PKMLMNAMAPTMAPK14 | |
| SCHEMBL28265648 | 0.81 | HRH4 (0.46) | ALDH1A1MAPTMAPK14HRH4BRAF | |
| SCHEMBL28267214 | 0.81 | PTGDR (0.57) | PTGDR | |
| SCHEMBL28151149 | 0.78 | HRH4 (0.64) | HRH4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105143206-B | Pyrimidine -2,4- diamine derivative for treating cancer | 托马斯·黑勒戴药物研究基金会 | 2019-01-15 | — | — | CN | claimed |
| CN-106794181-A | MTH1 inhibitors for the treatment of inflammatory and autoimmune conditions | 托马斯·黑勒戴药物研究基金会 | 2017-05-31 | — | — | CN | disclosed |