Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.51 |
| ▸ | NR1H2 | P55055 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CTRC | Q99895 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | DPP4 | P27487 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL25825132 | 1.00 | CYP1A2 (0.60) | CYP1A2NR1H3NR1H2KDM4ELMNA | |
| SCHEMBL15796875 | 0.87 | CYP1A2 (0.71) | CYP1A2NR1H3NR1H2KDM4ELMNA | |
| SCHEMBL21295763 | 0.87 | CYP1A2 (0.71) | CYP1A2NR1H3NR1H2KDM4ELMNA | |
| SCHEMBL30986821 | 0.87 | CYP1A2 (0.71) | CYP1A2NR1H3NR1H2KDM4ELMNA | |
| SCHEMBL17655924 | 0.87 | CYP1A2 (0.71) | CYP1A2NR1H3NR1H2KDM4ELMNA | |
| SCHEMBL23624501 | 0.87 | CYP1A2 (0.71) | CYP1A2NR1H3NR1H2KDM4ELMNA | |
| SCHEMBL29379884 | 0.87 | CYP1A2 (0.71) | CYP1A2NR1H3NR1H2KDM4ELMNA | |
| SCHEMBL20894736 | 0.85 | CYP1A2 (0.67) | CYP1A2NR1H3NR1H2KDM4ELMNA | |
| SCHEMBL9889000 | 0.85 | CYP1A2 (0.67) | CYP1A2NR1H3NR1H2KDM4ELMNA | |
| SCHEMBL17104884 | 0.85 | RAB9A (0.60) | NR1H3NR1H2LMNAL3MBTL1ALDH1A1 |
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-2023125801-A1 | 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 | 2023-07-06 | — | — | WO | disclosed |