Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | CASP3 | P42574 | 2/20 | 0.41 |
| ▸ | CASP4 | P49662 | 2/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | CASP9 | P55211 | 2/20 | 0.41 |
| ▸ | CASP6 | P55212 | 2/20 | 0.41 |
| ▸ | SNCA | P37840 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CASP8 | Q14790 | 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 | |
|---|---|---|---|---|
| SCHEMBL30672820 | 0.74 | GAA (0.48) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL16370713 | 0.74 | GAA (0.48) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL18421420 | 0.73 | GRIN1 (0.51) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL6920990 | 0.73 | ACHE (0.58) | KMT2AALDH1A1 | |
| SCHEMBL13233746 | 0.72 | CASP1 (0.39) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL2061766 | 0.72 | POLB (0.47) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL2062235 | 0.69 | GRIN1 (0.44) | CASP6KMT2AMAPTALDH1A1L3MBTL1 | |
| SCHEMBL15337535 | 0.69 | REN (0.46) | KMT2AMAPTALDH1A1 | |
| SCHEMBL21753084 | 0.69 | CASP1 (0.49) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL13233720 | 0.68 | F2RL3 (0.41) | CASP1CASP3CASP4CASP7CASP9 |
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-2012059932-A1 | 2, 4 -DIAMINOPYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2012-05-10 | — | — | WO | disclosed |