Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 15/20 | 0.46 |
| ▸ | CASP3 | P42574 | 3/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6893774 | 0.98 | CASP1 (0.47) | CASP1CASP3 | |
| SCHEMBL6609604 | 0.98 | CASP1 (0.47) | CASP1CASP3 | |
| SCHEMBL6767512 | 0.92 | CASP1 (0.38) | CASP1CASP3CASP6CASP8ALDH1A1 | |
| SCHEMBL6609756 | 0.91 | CASP1 (0.40) | CASP1ALDH1A1 | |
| SCHEMBL6611741 | 0.91 | CASP3 (0.48) | CASP1CASP3CASP6CASP8 | |
| SCHEMBL6612945 | 0.90 | CASP1 (0.40) | CASP1CASP3ALDH1A1 | |
| SCHEMBL6609107 | 0.88 | CASP3 (0.42) | CASP1CASP3CASP6CASP8 | |
| SCHEMBL6613054 | 0.86 | CASP1 (0.37) | CASP1ALDH1A1 | |
| SCHEMBL6609420 | 0.85 | CASP1 (0.48) | CASP1CASP3CASP6CASP8 | |
| SCHEMBL6611891 | 0.84 | CASP3 (0.40) | CASP1CASP3CASP6CASP8ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1212309-B1 | CASPASE INHIBITOR | LG CHEM INVESTMENT LTD (KR) | 2004-08-18 | — | — | EP | claimed |
| US-6747050-B1 | INHIBITING THE ACTIVITY OF CASPASES, PREVENTING INFLAMMATION AND APOPTOSIS | LG CHEM INVESTMENT LTD. (KR) | 2004-06-08 | — | — | US | claimed |
| WO-2001021599-A1 | CASPASE INHIBITOR | LG CHEMICAL LTD. (KR) | 2001-03-29 | — | — | WO | claimed |
| EP-1212309-B1 | CASPASE INHIBITOR | LG CHEM INVESTMENT LTD (KR) | 2004-08-18 | — | — | EP | disclosed |
| US-6747050-B1 | INHIBITING THE ACTIVITY OF CASPASES, PREVENTING INFLAMMATION AND APOPTOSIS | LG CHEM INVESTMENT LTD. (KR) | 2004-06-08 | — | — | US | disclosed |