Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRR1 | P24046 | 3/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.31 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13282790 | 0.84 | CA14 (0.34) | GABRR1HDAC6HDAC1HDAC2LMNA | |
| SCHEMBL19356231 | 0.84 | HDAC6 (0.33) | GABRR1HDAC6HDAC1HDAC2LMNA | |
| SCHEMBL7810945 | 0.79 | CA12 (0.34) | HDAC6HDAC1HDAC2CA14CA12 | |
| SCHEMBL5402224 | 0.79 | MAPK1 (0.37) | HDAC6HDAC1HDAC2CA14CA12 | |
| SCHEMBL10490853 | 0.78 | HDAC6 (0.33) | HDAC6HDAC1HDAC2CA14 | |
| SCHEMBL6687835 | 0.77 | HDAC6 (0.39) | HDAC6HDAC1HDAC2CA14CA12 | |
| SCHEMBL6285478 | 0.76 | HDAC6 (0.34) | HDAC6HDAC1HDAC2CA14CA12 | |
| SCHEMBL6285387 | 0.74 | HDAC6 (0.33) | HDAC6HDAC1HDAC2CA14CA12 | |
| SCHEMBL31236527 | 0.74 | MEN1 (0.36) | LMNACA14CA12CA1CA2 | |
| SCHEMBL31236543 | 0.74 | MEN1 (0.36) | LMNACA14CA12CA1CA2 |
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-115175738-A | Conjugates undergoing intramolecular rearrangement | 阿森迪斯药物股份有限公司 | 2022-10-11 | — | — | CN | disclosed |