Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | IAPP | P10997 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.39 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22889056 | 0.81 | TRPA1 (0.46) | HTTAKR1B10AKR1B1AKR1C3IAPP | |
| SCHEMBL21363014 | 0.80 | RNASEH1 (0.42) | HTTAKR1B10AKR1B1AKR1C3IAPP | |
| SCHEMBL21363203 | 0.80 | MCL1 (0.45) | HTTAKR1B10AKR1B1AKR1C3IAPP | |
| SCHEMBL21363209 | 0.79 | AMY1A (0.45) | AMY1AHTTAKR1B10AKR1B1AKR1C3 | |
| SCHEMBL1285885 | 0.78 | TAAR1 (0.46) | AMY1AHTTAKR1B10AKR1B1AKR1C3 | |
| SCHEMBL1759263 | 0.77 | AMY1A (0.53) | AMY1AHTTAKR1B10AKR1B1AKR1C3 | |
| SCHEMBL10909378 | 0.75 | HTT (0.62) | AMY1AHTTAKR1B10AKR1B1AKR1C3 | |
| SCHEMBL13284802 | 0.74 | AMY1A (0.55) | AMY1AHTTALDH1A1HPGDCSNK2A1 | |
| SCHEMBL3821503 | 0.73 | GABRA1 (0.66) | AMY1AHTTAKR1B1PTGS1ALDH1A1 | |
| SCHEMBL29394182 | 0.73 | GABRA1 (0.66) | AMY1AHTTAKR1B1PTGS1ALDH1A1 |
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-2019178119-A1 | AMINOCOUMARIN COMPOUNDS AND METHODS OF THEIR USE | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2019-09-19 | — | — | WO | disclosed |