Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 13/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 3/20 | 0.38 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6610840 | 0.89 | CASP1 (0.41) | CASP1CASP3PIN1CTSK | |
| SCHEMBL6610549 | 0.89 | CASP1 (0.49) | CASP1CASP3CASP8 | |
| SCHEMBL6609214 | 0.89 | CASP3 (0.48) | CASP1CASP3CASP8 | |
| SCHEMBL6612467 | 0.79 | CASP1 (0.47) | CASP1CASP3PIN1CTSK | |
| SCHEMBL6610158 | 0.77 | KDM4C (0.39) | CTSK | |
| SCHEMBL6613047 | 0.77 | CASP1 (0.39) | CASP1CASP3CASP8CTSK | |
| SCHEMBL6615960 | 0.76 | CASP1 (0.41) | CASP1CASP3PIN1 | |
| SCHEMBL6612579 | 0.72 | ITGB3 (0.43) | CASP1CASP3CASP8 | |
| SCHEMBL6611152 | 0.71 | CASP3 (0.47) | CASP3CASP8CTSK | |
| SCHEMBL6769747 | 0.70 | CASP1 (0.39) | CASP1CASP3 |
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 |
| 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 |
| WO-2001021599-A1 | CASPASE INHIBITOR | LG CHEMICAL LTD. (KR) | 2001-03-29 | — | — | WO | disclosed |