Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 5/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1713073 | 0.82 | ALDH1A1 (0.50) | AHRALDH1A1IDO1 | |
| SCHEMBL3646752 | 0.78 | ALDH1A1 (0.46) | AHRALDH1A1 | |
| SCHEMBL811578 | 0.71 | ALDH1A1 (0.59) | AHRALDH1A1 | |
| SCHEMBL3786357 | 0.69 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL4123128 | 0.68 | TSHR (0.53) | AHRALDH1A1IDO1 | |
| SCHEMBL441794 | 0.68 | — | — | |
| SCHEMBL16562812 | 0.67 | CYP1A1 (0.43) | AHRALDH1A1IDO1 | |
| SCHEMBL21263 | 0.66 | ALDH1A1 (0.69) | AHRALDH1A1 | |
| SCHEMBL388334 | 0.66 | ALDH1A1 (0.69) | AHRALDH1A1 | |
| SCHEMBL8487167 | 0.66 | TSHR (0.38) | 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 |
|---|---|---|---|---|---|---|---|
| US-5932731-A | HYDROLYZING A HETEROAROMATIC HALOGENATED METHYL SULFIDE IN PRESENCE OF AN ACID | SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) | 1999-08-03 | — | — | US | disclosed |
| US-5741933-A | HYDROLYSIS; OXIDATION | SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) | 1998-04-21 | — | — | US | disclosed |