Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 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 | |
|---|---|---|---|---|
| SCHEMBL25358161 | 1.00 | SIGMAR1 (0.46) | SIGMAR1KCNH2DRD3GID4TAAR1 | |
| SCHEMBL25355241 | 0.82 | TAAR1 (0.42) | SIGMAR1TAAR1 | |
| SCHEMBL25357922 | 0.82 | TAAR1 (0.42) | SIGMAR1TAAR1 | |
| SCHEMBL25358590 | 0.82 | TAAR1 (0.42) | SIGMAR1TAAR1 | |
| SCHEMBL14906788 | 0.79 | SIGMAR1 (0.56) | SIGMAR1KCNH2TAAR1 | |
| SCHEMBL25355547 | 0.78 | PNMT (0.32) | — | |
| SCHEMBL25357944 | 0.78 | PNMT (0.32) | — | |
| SCHEMBL31387328 | 0.78 | PNMT (0.32) | — | |
| SCHEMBL25358449 | 0.78 | PNMT (0.32) | — | |
| SCHEMBL25357162 | 0.78 | PNMT (0.32) | — |
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-2023154344-A1 | 2-METHYL-4',5'-DIHYDROSPIRO[PIPERIDINE-4,7'-THIENO[2,3-C]PYRAN] DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-08-17 | — | — | WO | disclosed |