Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | SHBG | P04278 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.43 |
| ▸ | TNKS | O95271 | 2/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | MIF | P14174 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | GABRP | O00591 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25825140 | 0.86 | GABRP (0.49) | CYP2A6ALOX5MAOBMAOASHBG | |
| SCHEMBL6583412 | 0.84 | ALOX5 (0.66) | ALOX5MAOBMAOASHBGPTPN1 | |
| SCHEMBL19887207 | 0.83 | GABRP (0.58) | MAOBMAOASHBGPTPN1CYP1A2 | |
| SCHEMBL19683686 | 0.81 | NPC1 (0.47) | CYP2A6MAOBSHBGPTPN1SMN1; SMN2 | |
| SCHEMBL11613110 | 0.79 | MAOB (0.68) | ALOX5MAOBMAOASHBGPTPN1 | |
| SCHEMBL11733704 | 0.78 | KCNA5 (0.62) | MAOBPTPN1SMN1; SMN2TNKSCA1 | |
| SCHEMBL29939110 | 0.77 | MAOB (0.66) | ALOX5MAOBMAOAPTPN1PTPRC | |
| SCHEMBL26103640 | 0.77 | MAOB (0.66) | ALOX5MAOBMAOAPTPN1PTPRC | |
| SCHEMBL29182290 | 0.76 | MAOB (0.65) | ALOX5MAOBMAOAPTPN1PTPRC | |
| SCHEMBL31290937 | 0.76 | MAOB (0.65) | ALOX5MAOBMAOAPTPN1PTPRC |
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-2023132488-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2023-07-13 | — | — | WO | disclosed |