Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL27427543 | 0.88 | SMN1; SMN2 (0.41) | NPSR1SMN1; SMN2 | |
| SCHEMBL27307308 | 0.86 | CACNA2D1 (0.34) | — | |
| SCHEMBL27307796 | 0.84 | CYP2D6 (0.31) | SMN1; SMN2 | |
| SCHEMBL19591969 | 0.84 | KDM4E (0.32) | — | |
| SCHEMBL27304363 | 0.84 | L3MBTL3 (0.31) | — | |
| SCHEMBL18994380 | 0.83 | KDM1A (0.30) | — | |
| SCHEMBL27307717 | 0.83 | CYP2D6 (0.31) | SMN1; SMN2 | |
| SCHEMBL27308130 | 0.83 | — | — | |
| SCHEMBL16997008 | 0.82 | DAO (0.31) | — | |
| SCHEMBL27307747 | 0.82 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023020519-A1 | 1, 4-OXAZEPANE DERIVATIVES AND USES THEREOF | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2023-02-23 | — | — | WO | disclosed |
| WO-2022188729-A1 | FUSED RING DERIVATIVES USEFUL AS KRAS G12D INHIBITORS | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2022-09-15 | — | — | WO | disclosed |