Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 14/20 | 0.42 |
| ▸ | TDO2 | P48775 | 13/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | AOC1 | P19801 | 2/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9846994 | 0.98 | IDO1 (0.41) | IDO1TDO2ADRB2ADRB1ADRB3 | |
| SCHEMBL9042917 | 0.82 | AOC1 (0.36) | IDO1ADRB2ADRB1ADRB3EPHX1 | |
| Hydrochloric Acid SCHEMBL9042172 | 0.81 | AOC3 (0.38) | IDO1ADRB2ADRB1ADRB3AOC1 | |
| SCHEMBL23882954 | 0.72 | DHODH (0.50) | IDO1TDO2EPHX1 | |
| SCHEMBL22984539 | 0.72 | DHODH (0.50) | IDO1TDO2EPHX1 | |
| SCHEMBL5282911 | 0.70 | BRS3 (0.42) | IDO1TDO2EPHX1 | |
| SCHEMBL9846996 | 0.70 | GAA (0.43) | ADRB2ADRB1ADRB3AOC1AOC3 | |
| SCHEMBL9846960 | 0.69 | GAA (0.39) | ADRB2ADRB1ADRB3AOC1AOC3 | |
| SCHEMBL1516653 | 0.69 | AAK1 (0.38) | IDO1TDO2EPHX1 | |
| SCHEMBL23495784 | 0.69 | OPRL1 (0.39) | IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0435222-A2 | Aminopyridinylmethanols and aminomethylpyridinamines and related compounds, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-07-03 | — | — | EP | claimed |
| EP-0435222-A2 | Aminopyridinylmethanols and aminomethylpyridinamines and related compounds, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-07-03 | — | — | EP | disclosed |