Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779804 | 0.86 | KDM4E (0.38) | KDM4EALDH1A1TDP1 | |
| SCHEMBL8488706 | 0.82 | TSHR (0.43) | ALDH1A1 | |
| SCHEMBL8488711 | 0.80 | — | — | |
| SCHEMBL7940598 | 0.74 | NR1H2 (0.50) | KDM4EALDH1A1TDP1 | |
| SCHEMBL15063439 | 0.74 | SLC6A4 (0.45) | IDO1KDM4EALDH1A1TDP1 | |
| SCHEMBL7938138 | 0.74 | ALDH1A1 (0.36) | KDM4EALDH1A1TDP1 | |
| SCHEMBL6933019 | 0.74 | CYP2A6 (0.42) | KDM4EALDH1A1TDP1 | |
| SCHEMBL5919354 | 0.74 | ALDH1A1 (0.58) | IDO1KDM4EALDH1A1TDP1 | |
| SCHEMBL10489143 | 0.72 | SMN1; SMN2 (0.45) | ALDH1A1 | |
| SCHEMBL23569923 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| 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 |