Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | COMT | P21964 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL20542255 | 0.66 | MAPK8 (0.36) | ALDH1A1HTTHSD17B10GFER | |
| SCHEMBL9393869 | 0.60 | — | — | |
| SCHEMBL14409569 | 0.59 | — | — | |
| SCHEMBL3068150 | 0.47 | SCN4A (0.62) | ALDH1A1COMT | |
| SCHEMBL1272596 | 0.44 | KDM4E (0.36) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL27843599 | 0.40 | — | — | |
| SCHEMBL17204111 | 0.36 | — | — | |
| SCHEMBL83260 | 0.36 | — | — | |
| Hydrochloric Acid SCHEMBL1449238 | 0.31 | — | — | |
| SCHEMBL49871 | 0.31 | ALOX12 (0.46) | ALDH1A1HSD17B10TDP1 |
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-5055587-A | One-step, high yields | FUJI PHOTO FILM CO., LTD. (JP) | 1991-10-08 | — | — | US | claimed |