Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 3/20 | 0.48 |
| ▸ | RIPK1 | Q13546 | 12/20 | 0.46 |
| ▸ | KLK1 | P06870 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20095692 | 0.88 | KLKB1 (0.47) | KLKB1RIPK1KLK1HDAC1HDAC6 | |
| SCHEMBL19658305 | 0.84 | KLKB1 (0.50) | KLKB1RIPK1KLK1HDAC1HDAC6 | |
| SCHEMBL1414358 | 0.84 | KLKB1 (0.49) | KLKB1RIPK1KLK1HDAC1HDAC6 | |
| SCHEMBL24311093 | 0.82 | HDAC1 (0.49) | HDAC1HDAC6ALDH1A1 | |
| SCHEMBL11584045 | 0.81 | KLKB1 (0.50) | KLKB1RIPK1KLK1HDAC1HDAC6 | |
| SCHEMBL24094026 | 0.81 | KLKB1 (0.59) | KLKB1RIPK1KLK1HDAC1HDAC6 | |
| SCHEMBL1719033 | 0.81 | ALDH1A1 (0.56) | KLKB1RIPK1KLK1ALDH1A1 | |
| SCHEMBL1414421 | 0.81 | KLKB1 (0.50) | KLKB1RIPK1KLK1HDAC1HDAC6 | |
| SCHEMBL18372877 | 0.81 | KLKB1 (0.56) | KLKB1RIPK1KLK1HDAC1HDAC6 | |
| SCHEMBL1261550 | 0.79 | SMN1; SMN2 (0.41) | KLKB1RIPK1L3MBTL1 |
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-3978492-A1 | BICYCLIC COMPOUND AS RIP-1 KINASE INHIBITOR AND APPLICATION THEREOF | Medshine Discovery Inc. (CN) | 2022-04-06 | — | — | EP | disclosed |