Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.33 |
| ▸ | GPR183 | P32249 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | MAOA | P21397 | 2/20 | 0.31 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL21949126 | 0.74 | GABRA1 (0.48) | GABRA1SIGMAR1TRPA1MEN1KMT2A | |
| SCHEMBL564461 | 0.73 | GABRA1 (0.57) | GABRA1SIGMAR1TRPA1MEN1KMT2A | |
| SCHEMBL29642252 | 0.69 | ALDH1A1 (0.47) | GABRA1SIGMAR1MEN1KMT2ATUBB1 | |
| SCHEMBL336067 | 0.69 | ALDH1A1 (0.47) | GABRA1SIGMAR1MEN1KMT2ATUBB1 | |
| A-226 SCHEMBL4455484 | 0.68 | SIGMAR1 (1.00) | GABRA1SIGMAR1TRPA1MEN1KMT2A | |
| A-226 SCHEMBL3405855 | 0.68 | SIGMAR1 (1.00) | GABRA1SIGMAR1TRPA1MEN1KMT2A | |
| A-226 SCHEMBL3405856 | 0.68 | SIGMAR1 (1.00) | GABRA1SIGMAR1TRPA1MEN1KMT2A | |
| SCHEMBL16958944 | 0.66 | GABRA1 (0.47) | GABRA1SIGMAR1TUBB1GPR183ALOX5 | |
| SCHEMBL2028471 | 0.65 | GABRA1 (0.51) | GABRA1SIGMAR1MEN1KMT2AALOX5 | |
| SCHEMBL2165060 | 0.65 | GABRA1 (0.51) | GABRA1SIGMAR1MEN1KMT2AALOX5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3919474-B1 | HBV INHIBITOR AND USE THEREOF | XIAN XINTONG PHARMACEUTICAL RES CO LTD (CN) | 2023-10-11 | — | — | EP | disclosed |