Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GGPS1 | O95749 | 1/20 | 0.31 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.31 |
| ▸ | SORD | Q00796 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | ALPI | P09923 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25073022 | 0.89 | ALOX5 (0.44) | GGPS1CYP1A2ALDH1A1KDM4EMEN1 | |
| SCHEMBL27452035 | 0.85 | PLA2G2A (0.35) | GAAL3MBTL1HSP90AA1 | |
| SCHEMBL23018907 | 0.85 | MMP12 (0.37) | HPGDALDH1A1KDM4EMEN1CYP3A4 | |
| SCHEMBL23098282 | 0.84 | KMT2A (0.32) | CA12ALDH2AKR1B1MAOAMAOB | |
| SCHEMBL27451637 | 0.82 | ALOX5 (0.40) | GGPS1CYP1A1CYP1A2CYP1B1ALDH1A1 | |
| SCHEMBL22845313 | 0.81 | CDC14B (0.32) | CA12ALDH2AKR1B1MAOAMAOB | |
| SCHEMBL21968791 | 0.81 | AHR (0.41) | CYP1A2MAOAHPGDALDH1A1KDM4E | |
| SCHEMBL27451388 | 0.80 | PLA2G2A (0.36) | HPGDALDH1A1KDM4EGAARECQL | |
| SCHEMBL22136056 | 0.80 | MAPT (0.37) | GGPS1HPGDALDH1A1KDM4EMEN1 | |
| SCHEMBL23098310 | 0.80 | CDC14B (0.32) | GGPS1HPGDALDH1A1KDM4EMEN1 |
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-2021049819-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2021-03-18 | — | — | WO | disclosed |