Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 5/20 | 0.51 |
| ▸ | PARP1 | P09874 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | DHODH | Q02127 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | PAK4 | O96013 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | CSF1R | P07333 | 1/20 | 0.41 |
| ▸ | RET | P07949 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2123532 | 0.86 | NR4A2 (0.50) | NR4A2PARP1ALDH1A1SMN1; SMN2DHODH | |
| SCHEMBL2123408 | 0.83 | NR4A2 (0.47) | NR4A2PARP1ALDH1A1SMN1; SMN2DHODH | |
| SCHEMBL21244187 | 0.80 | NR4A2 (0.51) | NR4A2PARP1ALDH1A1DHODHNPC1 | |
| SCHEMBL14843478 | 0.76 | NR4A2 (0.51) | NR4A2PARP1DHODHNPC1L3MBTL1 | |
| SCHEMBL29417341 | 0.76 | NR4A2 (0.51) | NR4A2PARP1DHODHNPC1L3MBTL1 | |
| SCHEMBL13783330 | 0.76 | NR4A2 (0.51) | NR4A2PARP1ALDH1A1SMN1; SMN2DHODH | |
| SCHEMBL18106120 | 0.76 | PARP1 (0.50) | PARP1ALDH1A1SMN1; SMN2NPC1HSP90AA1 | |
| SCHEMBL31290662 | 0.75 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2NPC1HSP90AA1L3MBTL1 | |
| SCHEMBL10884002 | 0.75 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2NPC1HSP90AA1L3MBTL1 | |
| SCHEMBL247759 | 0.74 | NR4A2 (0.50) | NR4A2PARP1ALDH1A1DHODHNPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-54115382-A | — | — | None | — | — | JP | disclosed |
| JP-S54115382-A | SEPARATION OF HIGH-PURITY 8-CHLORO-4-ETHYLQUINALDINE | TEIJIN LTD | 1979-09-07 | — | — | JP | disclosed |