Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 1/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.48 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.42 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2655817 | 0.86 | PYCR1 (0.54) | PYCR1SLC6A2SLC6A4SLC6A3IDO1 | |
| SCHEMBL2662012 | 0.81 | SLC6A2 (0.47) | PYCR1SLC6A2SLC6A4SLC6A3IDO1 | |
| SCHEMBL8699270 | 0.79 | PYCR1 (0.50) | PYCR1SLC6A2SLC6A4SLC6A3IDO1 | |
| SCHEMBL16553471 | 0.77 | PYCR1 (0.61) | PYCR1SLC6A2SLC6A4SLC6A3IDO1 | |
| SCHEMBL2655848 | 0.76 | PYCR1 (0.59) | PYCR1SLC6A2SLC6A4SLC6A3IDO1 | |
| Hydrochloric Acid SCHEMBL8648703 | 0.76 | PYCR1 (0.59) | PYCR1SLC6A2SLC6A4SLC6A3IDO1 | |
| SCHEMBL15084293 | 0.74 | IDO1 (0.50) | IDO1CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2424845 | 0.74 | IDO1 (0.50) | IDO1CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8392172 | 0.74 | ALDH1A1 (0.49) | PYCR1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL5908877 | 0.74 | IDO1 (0.54) | PYCR1SLC6A2SLC6A4IDO1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4265608-A1 | BENZOHETEROCYCLE SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUND | Shanghai Jemincare Pharmaceuticals Co., Ltd. (CN) | 2023-10-25 | — | — | EP | disclosed |