Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.42 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA9 | Q16790 | 4/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.40 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23237576 | 0.97 | MCL1 (0.43) | CA12CA1CA2CA9MCL1 | |
| SCHEMBL23238255 | 0.97 | MCL1 (0.43) | CA12CA1CA2CA9MCL1 | |
| SCHEMBL23239479 | 0.97 | MCL1 (0.43) | CA12CA1CA2CA9MCL1 | |
| SCHEMBL23239393 | 0.97 | MCL1 (0.43) | CA12CA1CA2CA9MCL1 | |
| SCHEMBL25089236 | 0.96 | CA12 (0.41) | CA12CA1CA2CA9MCL1 | |
| SCHEMBL26063488 | 0.96 | MCL1 (0.44) | CA12CA1CA2CA9MCL1 | |
| SCHEMBL25088647 | 0.96 | CA12 (0.40) | CA12CA1CA2CA9MCL1 | |
| SCHEMBL25089138 | 0.96 | CA12 (0.46) | CA12CA1CA2CA9MCL1 | |
| SCHEMBL23237597 | 0.96 | MCL1 (0.44) | CA12CA1CA2CA9MCL1 | |
| SCHEMBL26055009 | 0.96 | MCL1 (0.44) | CA12CA1CA2CA9MCL1 |
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-2023027173-A1 | COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2023-03-02 | — | — | WO | disclosed |