Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 8/20 | 0.40 |
| ▸ | PSMB1 | P20618 | 7/20 | 0.39 |
| ▸ | PSMB5 | P28074 | 7/20 | 0.39 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL25318426 | 1.00 | AAK1 (0.40) | AAK1PSMB1PSMB5PSMB2TRPA1 | |
| SCHEMBL25318429 | 1.00 | AAK1 (0.40) | AAK1PSMB1PSMB5PSMB2TRPA1 | |
| SCHEMBL31362889 | 0.89 | AAK1 (0.37) | AAK1PSMB1PSMB5PSMB2TRPA1 | |
| SCHEMBL31058397 | 0.86 | AAK1 (0.35) | AAK1PSMB1PSMB5FPR2 | |
| SCHEMBL25321749 | 0.86 | AAK1 (0.35) | AAK1PSMB1PSMB5FPR2 | |
| SCHEMBL25321744 | 0.86 | AAK1 (0.35) | AAK1PSMB1PSMB5FPR2 | |
| SCHEMBL31058404 | 0.84 | PSMB1 (0.40) | AAK1PSMB1PSMB5PSMB2TRPA1 | |
| SCHEMBL25319630 | 0.84 | PSMB1 (0.40) | AAK1PSMB1PSMB5PSMB2TRPA1 | |
| SCHEMBL25319637 | 0.84 | PSMB1 (0.40) | AAK1PSMB1PSMB5PSMB2TRPA1 | |
| SCHEMBL31388966 | 0.82 | AAK1 (0.39) | AAK1PSMB1PSMB5 |
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-118591537-A | PARP7 inhibitors | 吉利德科学公司 | 2024-09-03 | — | — | CN | disclosed |