Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PTPRC | P08575 | 3/20 | 0.37 |
| ▸ | S100A4 | P26447 | 2/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP4 | P49662 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | CASP9 | P55211 | 1/20 | 0.37 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9682129 | 0.86 | ALDH1A1 (0.36) | ALDH1A1NR1H2NR1H3MEN1KMT2A | |
| SCHEMBL9680894 | 0.82 | RARA (0.33) | MEN1KMT2ARAB9APTPRCMALT1 | |
| SCHEMBL9681507 | 0.82 | CASP1 (0.42) | ALDH1A1RAB9AACHECASP3CASP1 | |
| SCHEMBL9682813 | 0.80 | PDE4A (0.37) | CASP3MALT1 | |
| SCHEMBL9682845 | 0.78 | PDGFRB (0.41) | ALDH1A1NR1H2NR1H3MEN1KMT2A | |
| SCHEMBL9680331 | 0.77 | RARA (0.40) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8090699 | 0.74 | ALDH1A1 (0.37) | ALDH1A1NR1H2NR1H3MEN1KMT2A | |
| SCHEMBL10697020 | 0.73 | ALDH1A1 (0.36) | ALDH1A1MEN1KMT2APTPRCS100A4 | |
| SCHEMBL8085305 | 0.73 | ALDH1A1 (0.36) | ALDH1A1MEN1KMT2APTPRCS100A4 | |
| SCHEMBL8077039 | 0.73 | ALDH1A1 (0.36) | ALDH1A1MEN1KMT2APTPRCS100A4 |
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-5112839-A | CHROMAN DERIVATIVES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-05-12 | — | — | US | disclosed |