Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 5/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17713835 | 0.81 | MEN1 (0.43) | GFERHTR7KMT2A | |
| SCHEMBL17713869 | 0.73 | GFER (0.47) | GFERHTR7ACHEALDH1A1KMT2A | |
| SCHEMBL7249663 | 0.67 | ACHE (0.48) | GFERHTR7ACHEALDH1A1KMT2A | |
| SCHEMBL7251855 | 0.67 | ACHE (0.48) | GFERHTR7ACHEALDH1A1KMT2A | |
| SCHEMBL11620812 | 0.67 | SLC6A2 (0.56) | GFERHTR7ACHEMAOBMAOA | |
| Water SCHEMBL11852500 | 0.67 | MAOB (0.44) | GFERHTR7ACHEALDH1A1KMT2A | |
| SCHEMBL4294410 | 0.66 | RIPK1 (0.50) | ALDH1A1MAOBMAOATDP1RIPK1 | |
| Benzene SCHEMBL17713935 | 0.65 | ALDH1A1 (0.33) | ALDH1A1KMT2ATDP1 | |
| SCHEMBL16181385 | 0.64 | CYP19A1 (0.45) | ALDH1A1MAOBMAOARECQLTDP1 | |
| SCHEMBL11617863 | 0.64 | SLC6A2 (0.52) | GFERHTR7ACHEMAOBMAOA |
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-107207441-B | Protein kinase inhibitors | 上海复尚慧创医药研究有限公司 | 2020-11-24 | — | — | CN | disclosed |