Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24744557 | 1.00 | CA12 (0.35) | CA12CA1CA2CA9SLC6A9 | |
| SCHEMBL24744534 | 0.99 | SLC6A9 (0.36) | CA12CA1CA2CA9SLC6A9 | |
| SCHEMBL24744513 | 0.98 | SLC6A9 (0.36) | CA12CA1CA2CA9SLC6A9 | |
| SCHEMBL24744524 | 0.96 | CA12 (0.33) | CA12CA1CA2CA9SLC6A9 | |
| SCHEMBL24744536 | 0.94 | SLC6A9 (0.34) | CA12CA1CA2CA9SLC6A9 | |
| SCHEMBL24744528 | 0.93 | SLC6A9 (0.35) | CA12CA1CA2CA9SLC6A9 | |
| SCHEMBL24744531 | 0.92 | CA12 (0.32) | CA12CA1CA2CA9SLC6A9 | |
| SCHEMBL24744518 | 0.92 | CA12 (0.34) | CA12CA1CA2CA9SLC6A9 | |
| SCHEMBL24744128 | 0.91 | GPR84 (0.31) | — | |
| SCHEMBL24744447 | 0.91 | CA12 (0.33) | CA12CA1CA2CA9SLC6A9 |
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-2022260240-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 엘티소재주식회사 | 2022-12-15 | — | — | WO | disclosed |