Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.36 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.35 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.35 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.35 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TOP2A | P11388 | 1/20 | 0.34 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14158155 | 1.00 | ALDH1A1 (0.37) | ALDH1A1KDM4EGLAGAACASP1 | |
| SCHEMBL14158322 | 0.77 | NOTUM (0.40) | ALDH1A1KDM4EGLAGAACASP1 | |
| SCHEMBL14158324 | 0.77 | NOTUM (0.40) | ALDH1A1KDM4EGLAGAACASP1 | |
| SCHEMBL14158252 | 0.74 | ALDH1A1 (0.34) | ALDH1A1KDM4EGLAGAACASP1 | |
| SCHEMBL14158254 | 0.74 | ALDH1A1 (0.34) | ALDH1A1KDM4EGLAGAACASP1 | |
| SCHEMBL22747759 | 0.73 | GRM4 (0.40) | ALDH1A1KDM4EGRM4MEN1KMT2A | |
| SCHEMBL27186117 | 0.70 | PIK3CD (0.38) | PRKAG1PRKAA1PRKAB1MEN1KMT2A | |
| SCHEMBL27186122 | 0.70 | PIK3CD (0.38) | PRKAG1PRKAA1PRKAB1MEN1KMT2A | |
| SCHEMBL15263566 | 0.70 | MPI (0.46) | ALDH1A1KDM4EHSD17B10GRM4MEN1 | |
| SCHEMBL31091757 | 0.69 | CRBN (0.52) | ALDH1A1TSHR |
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-2012170371-A1 | COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | N30 PHARMACEUTICALS, LLC (US) | 2012-12-13 | — | — | WO | disclosed |