Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.42 |
| ▸ | RELA | Q04206 | 2/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CTRC | Q99895 | 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 | |
|---|---|---|---|---|
| SCHEMBL29197490 | 0.92 | CYP1A2 (0.44) | CYP1A2MAP4K4NR1H2NR1H3SMN1; SMN2 | |
| SCHEMBL27477978 | 0.83 | ATM (0.41) | MAP4K4SMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL5498680 | 0.83 | NPC1 (0.46) | CYP1A2MAP4K4NR1H2NR1H3SMN1; SMN2 | |
| SCHEMBL582179 | 0.83 | NPC1 (0.58) | CYP1A2SMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL24944449 | 0.81 | CYP1A2 (0.79) | CYP1A2MAP4K4SMN1; SMN2NPC1PTGS2 | |
| SCHEMBL30969416 | 0.80 | CYP1A2 (0.56) | CYP1A2NR1H2NR1H3NPC1RAB9A | |
| SCHEMBL30471775 | 0.79 | ABCG2 (0.43) | SMN1; SMN2NPC1RAB9ANFKB1NFKB2 | |
| SCHEMBL8356292 | 0.79 | ABCG2 (0.43) | SMN1; SMN2NPC1RAB9ANFKB1NFKB2 | |
| SCHEMBL29926517 | 0.79 | CYP1A2 (0.74) | CYP1A2MAP4K4SMN1; SMN2PTGS2PTGS1 | |
| SCHEMBL1742859 | 0.79 | CYP1A2 (0.74) | CYP1A2MAP4K4SMN1; SMN2PTGS2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117940412-A | Fluoranthene derivative, light-emitting element, and photoelectric conversion element | 东丽先端材料研究开发（中国）有限公司 | 2024-04-26 | — | — | CN | disclosed |