Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.31 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.30 |
| ▸ | FYN | P06241 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | AHR | P35869 | 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 | |
|---|---|---|---|---|
| SCHEMBL26061395 | 0.94 | ALDH1A1 (0.38) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL21966031 | 0.92 | ALDH1A1 (0.37) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL26057313 | 0.92 | HPRT1 (0.39) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL19239068 | 0.91 | ALDH1A1 (0.40) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL26851637 | 0.89 | GPR3 (0.39) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL26061432 | 0.89 | HPRT1 (0.33) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL26020868 | 0.89 | ALDH1A1 (0.34) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL26021905 | 0.88 | ALDH1A1 (0.43) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL26056786 | 0.88 | HPRT1 (0.40) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL26057312 | 0.88 | ALDH1A1 (0.41) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4235829-A1 | ORGANIC LIGHT-EMITTING DEVICE | Lg Chem, Ltd. (KR) | 2023-08-30 | — | — | EP | disclosed |