Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | WEE1 | P30291 | 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 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.30 |
| ▸ | CCNC | P24863 | 1/20 | 0.30 |
| ▸ | CDK8 | P49336 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL22845313 | 0.90 | CDC14B (0.32) | ALDH1A1CA12ALDH2AKR1B1MAOA | |
| SCHEMBL23018907 | 0.87 | MMP12 (0.37) | KMT2AALDH1A1HPGDL3MBTL1 | |
| SCHEMBL27452307 | 0.87 | L3MBTL1 (0.34) | KMT2AALDH1A1MAPK1CA12MAOA | |
| SCHEMBL24065324 | 0.87 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL23098286 | 0.84 | GGPS1 (0.31) | KMT2AALDH1A1CA12ALDH2AKR1B1 | |
| SCHEMBL24257010 | 0.83 | WEE1 (0.33) | KMT2AALDH1A1ALOX15TSHRMAPK1 | |
| SCHEMBL27451757 | 0.83 | WEE1 (0.33) | WEE1 | |
| SCHEMBL27451690 | 0.83 | WEE1 (0.34) | ALDH1A1TSHRWEE1HPGDMAT2A | |
| SCHEMBL27452035 | 0.83 | PLA2G2A (0.35) | L3MBTL1 | |
| SCHEMBL27451692 | 0.82 | MMP12 (0.34) | ALDH1A1L3MBTL1 |
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 |