Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPA5 | P11021 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9330896 | 0.85 | MAPT (0.36) | HSPA5CA12CA2CA9ALDH1A1 | |
| SCHEMBL29399700 | 0.83 | ALDH1A1 (0.37) | HSPA5ALDH1A1MAPTHTTMEN1 | |
| SCHEMBL6561982 | 0.83 | ALDH1A1 (0.37) | HSPA5ALDH1A1MAPTHTTMEN1 | |
| SCHEMBL2712175 | 0.79 | HSPA5 (0.36) | HSPA5CA2ALDH1A1TSHRTDP1 | |
| SCHEMBL2799335 | 0.77 | BCL2 (0.50) | MEN1KMT2AHSD17B10HIF1A | |
| SCHEMBL9136438 | 0.75 | ALDH1A1 (0.41) | HSPA5ALDH1A1MAPTHTTMEN1 | |
| SCHEMBL29475280 | 0.74 | HSPA5 (0.50) | HSPA5CA12CA2CA9ALDH1A1 | |
| SCHEMBL9576033 | 0.71 | CYP2C9 (0.32) | HSPA5ALDH1A1HTTTP53HSD17B10 | |
| SCHEMBL9135602 | 0.71 | DHFR (0.45) | HSPA5CA2ALDH1A1MAPTHTT | |
| SCHEMBL932105 | 0.70 | KLF10 (0.47) | ALDH1A1MAPTHTTMEN1KMT2A |
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-5288896-A | 3,5-di-t-butyl-4-hydroxylphenylmethylhydroxylamines and their derivatives, pharmaceutical compositions, and methods of use therefor | WARNER-LAMBERT COMPANY (US) | 1994-02-22 | — | — | US | disclosed |