Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21803768 | 0.98 | HPRT1 (0.50) | HPRT1ALDH1A1CYP2A6HSD17B10TSHR | |
| SCHEMBL422347 | 0.77 | CYP2A6 (0.52) | ALDH1A1CYP2A6HSD17B10TSHRTDP1 | |
| SCHEMBL599097 | 0.77 | ALDH1A1 (0.73) | HPRT1ALDH1A1CYP2A6HSD17B10TSHR | |
| SCHEMBL412050 | 0.77 | ALDH1A1 (0.73) | HPRT1ALDH1A1CYP2A6HSD17B10TSHR | |
| Ammonia Solution, Strong SCHEMBL28546873 | 0.75 | CYP2A6 (0.50) | ALDH1A1CYP2A6TSHRCYP1A2MAPT | |
| Hydrochloric Acid SCHEMBL30901629 | 0.75 | CYP2A6 (0.50) | ALDH1A1CYP2A6TSHRTDP1CYP1A2 | |
| Methane SCHEMBL28367908 | 0.75 | ALDH1A1 (0.70) | HPRT1ALDH1A1CYP2A6HSD17B10TSHR | |
| SCHEMBL598522 | 0.75 | HPRT1 (0.64) | HPRT1ALDH1A1CYP2A6HSD17B10TSHR | |
| SCHEMBL31235727 | 0.75 | HPRT1 (0.64) | HPRT1ALDH1A1CYP2A6HSD17B10TSHR | |
| Chrysene SCHEMBL27805598 | 0.74 | HPRT1 (0.70) | HPRT1ALDH1A1CYP2A6HSD17B10TSHR |
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-2023234749-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2023-12-07 | — | — | WO | disclosed |