Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD3 | Q9NY59 | 3/20 | 0.56 |
| ▸ | IRAK4 | Q9NWZ3 | 9/20 | 0.53 |
| ▸ | AXL | P30530 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | CDK2 | P24941 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL946897 | 0.83 | IRAK4 (0.68) | SMPD3IRAK4AXLHTTHSD11B1 | |
| SCHEMBL309036 | 0.79 | IRAK4 (0.58) | SMPD3IRAK4AXLHTTHSD11B1 | |
| Formic Acid SCHEMBL29488713 | 0.78 | IRAK4 (0.62) | SMPD3IRAK4HTTHSD11B1SMN1; SMN2 | |
| SCHEMBL23807849 | 0.77 | SMPD3 (0.53) | SMPD3IRAK4AXLHTTCDK2 | |
| Hydrochloric Acid SCHEMBL30152392 | 0.77 | IRAK4 (0.57) | SMPD3IRAK4AXLHTTHSD11B1 | |
| Hydrochloric Acid SCHEMBL31474423 | 0.77 | IRAK4 (0.57) | SMPD3IRAK4AXLHTTHSD11B1 | |
| SCHEMBL10042194 | 0.76 | HTT (0.58) | SMPD3IRAK4AXLHTTHSD11B1 | |
| SCHEMBL22047582 | 0.76 | SMPD3 (0.51) | SMPD3IRAK4AXLHTTCDK2 | |
| SCHEMBL309358 | 0.76 | HSD11B1 (0.57) | SMPD3IRAK4AXLHTTHSD11B1 | |
| SCHEMBL31218890 | 0.76 | LMNA (0.54) | SMPD3IRAK4AXLHTTHSD11B1 |
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-113166156-B | Tyrosine kinase inhibitors, compositions and methods | 贝达药业股份有限公司 | 2024-02-27 | — | — | CN | disclosed |