Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.35 |
| ▸ | CDC25A | P30304 | 1/20 | 0.35 |
| ▸ | CDC25B | P30305 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1501079 | 0.91 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HSD17B10TDP1KMT2A | |
| SCHEMBL250199 | 0.81 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2HSD17B10TDP1KMT2A | |
| SCHEMBL8667209 | 0.77 | KMT2A (0.54) | ALDH1A1SMN1; SMN2KMT2AGAACA1 | |
| SCHEMBL8375198 | 0.77 | ALDH1A1 (0.42) | ALDH1A1HSD17B10TDP1KMT2AGAA | |
| SCHEMBL10593283 | 0.77 | ALDH1A1 (0.42) | ALDH1A1HSD17B10TDP1KMT2AGAA | |
| SCHEMBL8450545 | 0.76 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2KMT2APTGES2GAA | |
| SCHEMBL14740735 | 0.76 | ALDH1A1 (0.41) | ALDH1A1HSD17B10TDP1GAACA12 | |
| SCHEMBL812717 | 0.75 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HSD17B10KMT2AGAA | |
| SCHEMBL30690139 | 0.75 | ALDH1A1 (0.44) | ALDH1A1HSD17B10TDP1GAACA12 | |
| SCHEMBL489571 | 0.75 | ALDH1A1 (0.44) | ALDH1A1HSD17B10TDP1GAACA12 |
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-5811571-A | HALOGENATING AN AROMATIC OR HETEROAROMATIC METHYL SULFIDE OR METHYL SULFOXIDE IN PRESENCE OF WATER | SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) | 1998-09-22 | — | — | US | disclosed |