Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL28445463 | 0.94 | ALDH1A1 (0.43) | KDM4EALDH1A1LMNAHSD17B10L3MBTL1 | |
| SCHEMBL28451603 | 0.94 | ALDH1A1 (0.43) | KDM4EALDH1A1LMNAHSD17B10L3MBTL1 | |
| SCHEMBL28443055 | 0.89 | KDM4E (0.54) | KDM4EALDH1A1LMNAHSD17B10L3MBTL1 | |
| SCHEMBL28445422 | 0.88 | KDM4E (0.44) | KDM4EALDH1A1LMNAHSD17B10L3MBTL1 | |
| SCHEMBL28454187 | 0.88 | KDM4E (0.44) | KDM4EALDH1A1LMNAHSD17B10L3MBTL1 | |
| SCHEMBL28449191 | 0.87 | EGFR (0.43) | KDM4EALDH1A1LMNAHSD17B10L3MBTL1 | |
| SCHEMBL28452127 | 0.86 | KMT2A (0.40) | KDM4EALDH1A1LMNAHSD17B10EGFR | |
| SCHEMBL28449263 | 0.83 | KDM4E (0.52) | KDM4EALDH1A1LMNAHSD17B10L3MBTL1 | |
| SCHEMBL28447953 | 0.81 | HDAC6 (0.51) | KDM4EL3MBTL1HDAC6CRHBPCRHR2 | |
| SCHEMBL28898030 | 0.81 | HDAC6 (0.51) | KDM4EL3MBTL1HDAC6CRHBPCRHR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108997230-B | Quinoxaline derivative with matrix metalloproteinase inhibitory activity, preparation method and application thereof | 山东大学 | 2020-08-04 | — | — | CN | claimed |
| CN-108997230-B | Quinoxaline derivative with matrix metalloproteinase inhibitory activity, preparation method and application thereof | 山东大学 | 2020-08-04 | — | — | CN | disclosed |