Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.37 |
| ▸ | ICMT | O60725 | 1/20 | 0.37 |
| ▸ | ALB | P02768 | 1/20 | 0.37 |
| ▸ | SOAT2 | O75908 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7495271 | 0.94 | ALDH1A1 (0.51) | ALDH1A1NPSR1EPHX1HTTGAA | |
| SCHEMBL3628526 | 0.85 | ALDH1A1 (0.42) | ALDH1A1NPSR1EPHX1HTTMEN1 | |
| Hydrogen Sulfide SCHEMBL28258698 | 0.83 | ALDH1A1 (0.41) | ALDH1A1NPSR1EPHX1HTTMEN1 | |
| Hydrochloric Acid SCHEMBL28165709 | 0.82 | ALDH1A1 (0.40) | ALDH1A1NPSR1EPHX1HTTGAA | |
| SCHEMBL28165707 | 0.78 | ALDH1A1 (0.38) | ALDH1A1NPSR1EPHX1HTTGAA | |
| SCHEMBL6676668 | 0.76 | TDP1 (0.42) | ALDH1A1NPSR1EPHX1MEN1KMT2A | |
| Fluoride SCHEMBL5698487 | 0.74 | TDP1 (0.40) | ALDH1A1NPSR1EPHX1MEN1KMT2A | |
| SCHEMBL11775817 | 0.73 | EPHX2 (0.46) | SIGMAR1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL10474121 | 0.73 | ALDH1A1 (0.44) | ALDH1A1NPSR1EPHX1HTTGAA | |
| SCHEMBL7058665 | 0.72 | CYP1A2 (0.44) | ALDH1A1EPHX1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0903341-A1 | \"Novel ortho-mercaptoaniline compounds\ | Akzo Nobel N.V. (NL) | 1999-03-24 | — | — | EP | disclosed |