Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 6/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | CASP7 | P55210 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13395979 | 0.78 | KDM4E (0.65) | MAOAKDM4EALDH1A1NPC1LMNA | |
| SCHEMBL18243048 | 0.77 | KDM4E (0.64) | MAOAKDM4EALDH1A1NPC1LMNA | |
| Xanthone SCHEMBL7422094 | 0.75 | MAOA (0.69) | MAOAKDM4EALDH1A1NPC1LMNA | |
| SCHEMBL18646348 | 0.75 | KDM4E (0.39) | KDM4EALDH1A1NPC1LMNARAB9A | |
| SCHEMBL31193433 | 0.74 | MAOA (0.64) | MAOAKDM4EALDH1A1NPC1LMNA | |
| SCHEMBL6570481 | 0.74 | MAOA (0.64) | MAOAKDM4EALDH1A1NPC1LMNA | |
| SCHEMBL8711628 | 0.74 | MAOA (0.64) | MAOAKDM4EALDH1A1NPC1LMNA | |
| SCHEMBL12608741 | 0.73 | MAOA (0.68) | MAOAKDM4EALDH1A1NPC1LMNA | |
| SCHEMBL27886621 | 0.73 | CYP1A2 (0.73) | KDM4EALDH1A1LMNARAB9AMAPT | |
| SCHEMBL27448384 | 0.73 | MAOA (0.54) | MAOAKDM4EALDH1A1NPC1LMNA |
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-2019228430-A1 | KETONE-CONTAINING COMPOUND AND USE THEREOF IN ORGANIC ELECTROLUMINESCENT DEVICE | 江苏三月光电科技有限公司 (CN) | 2019-12-05 | — | — | WO | disclosed |