Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 10/20 | 0.38 |
| ▸ | JAK2 | O60674 | 5/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.37 |
| ▸ | AXL | P30530 | 1/20 | 0.36 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29088903 | 0.85 | NTRK1 (0.49) | SCN9ANTRK1 | |
| SCHEMBL21510296 | 0.85 | NTRK1 (0.49) | SCN9ANTRK1 | |
| SCHEMBL23473891 | 0.84 | NTRK1 (0.38) | NTRK1JAK2 | |
| SCHEMBL21229269 | 0.83 | NTRK1 (0.38) | NTRK1JAK2 | |
| SCHEMBL21229309 | 0.83 | FYN (0.38) | NTRK1 | |
| SCHEMBL16936088 | 0.77 | NTRK1 (0.44) | SCN9ANTRK1JAK2BRD4AXL | |
| SCHEMBL16946788 | 0.76 | SCN9A (0.46) | SCN9ANTRK1AXLCA12CA1 | |
| SCHEMBL19614330 | 0.75 | NTRK1 (0.39) | SCN9ANTRK1JAK2 | |
| SCHEMBL19827027 | 0.75 | NTRK1 (0.40) | SCN9ANTRK1JAK2BRD4PCSK9 | |
| SCHEMBL22916118 | 0.75 | NTRK1 (0.38) | NTRK1JAK2 |
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-2019149131-A1 | COMPOUND HAVING MACROCYCLIC MOLECULAR STRUCTURE AND USE THEREOF | 上海吉倍生物技术有限公司 | 2019-08-08 | — | — | WO | disclosed |