Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 1/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.38 |
| ▸ | PLA2G4A | P47712 | 2/20 | 0.38 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PRKDC | P78527 | 1/20 | 0.34 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22063079 | 0.99 | HSD17B1 (0.40) | HSD17B1HSD17B2PLA2G2APLA2G4APLA2G10 | |
| SCHEMBL26949748 | 0.97 | HSD17B1 (0.37) | HSD17B1HSD17B2PLA2G2APLA2G4ATDP1 | |
| SCHEMBL26949955 | 0.95 | TDP1 (0.37) | HSD17B1HSD17B2PLA2G2APLA2G4APLA2G10 | |
| SCHEMBL26950090 | 0.95 | ESR1 (0.37) | HSD17B1HSD17B2PLA2G2APLA2G4ATDP1 | |
| SCHEMBL26949832 | 0.95 | ESR1 (0.37) | HSD17B1HSD17B2PLA2G2APLA2G4ATDP1 | |
| SCHEMBL18382852 | 0.95 | L3MBTL1 (0.39) | HSD17B1HSD17B2TDP1L3MBTL1HDAC4 | |
| SCHEMBL29315873 | 0.94 | PLA2G2A (0.40) | HSD17B1HSD17B2PLA2G2APLA2G4APLA2G10 | |
| SCHEMBL26949752 | 0.93 | PLA2G2A (0.36) | HSD17B1HSD17B2PLA2G2APLA2G4APLA2G10 | |
| SCHEMBL24982978 | 0.93 | PLA2G2A (0.38) | HSD17B1HSD17B2PLA2G2APLA2G4APLA2G10 | |
| SCHEMBL29315922 | 0.93 | PLA2G2A (0.38) | HSD17B1HSD17B2PLA2G2APLA2G4APLA2G10 |
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-2023239193-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-12-14 | — | — | WO | disclosed |