Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL714059 | 0.82 | ALDH1A1 (0.39) | ALDH1A1KEAP1NFE2L2HCAR2CRBN | |
| SCHEMBL710767 | 0.82 | ALDH1A1 (0.39) | ALDH1A1KEAP1NFE2L2HCAR2CRBN | |
| SCHEMBL18184260 | 0.78 | CRBN (0.31) | CRBN | |
| SCHEMBL715075 | 0.77 | CRBN (0.33) | ALDH1A1CRBN | |
| SCHEMBL4611736 | 0.77 | CRBN (0.33) | ALDH1A1CRBN | |
| SCHEMBL23919967 | 0.72 | ALDH1A1 (0.33) | ALDH1A1CRBN | |
| SCHEMBL16168274 | 0.69 | — | — | |
| SCHEMBL19937378 | 0.69 | — | — | |
| SCHEMBL16543568 | 0.68 | — | — | |
| SCHEMBL13896472 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016172631-A2 | SUBSTRATE SELECTIVE INHIBITORS OF INSULIN-DEGRADING ENZYME (IDE) AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2016-10-27 | — | — | WO | disclosed |