Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK7 | P49862 | 1/20 | 0.38 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 8/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.36 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | YAP1 | P46937 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6612520 | 0.91 | CASP1 (0.43) | CASP1ITGB3ITGA2BCAPN1ELANE | |
| SCHEMBL7995107 | 0.86 | CASP1 (0.44) | CASP1ITGB3ITGA2BELANEATM | |
| SCHEMBL6772066 | 0.85 | KLK5 (0.40) | KLK7KLK5CASP1SYKCAPN1 | |
| SCHEMBL6615185 | 0.83 | ELANE (0.44) | CASP1CAPN1ELANECASP3ATM | |
| SCHEMBL6610648 | 0.80 | ELANE (0.41) | CASP1CAPN1ELANECASP3ATM | |
| SCHEMBL6613265 | 0.80 | CASP1 (0.37) | CASP1CASP3YAP1 | |
| SCHEMBL6612945 | 0.78 | CASP1 (0.40) | CASP1CASP3 | |
| SCHEMBL6611667 | 0.77 | ABCB1 (0.38) | KLK5ATM | |
| SCHEMBL6767512 | 0.76 | CASP1 (0.38) | CASP1CASP3 | |
| SCHEMBL14680593 | 0.74 | SYK (0.56) | KLK7KLK5CASP1SYK |
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 2 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 | disclosed |
| US-6747050-B1 | INHIBITING THE ACTIVITY OF CASPASES, PREVENTING INFLAMMATION AND APOPTOSIS | LG CHEM INVESTMENT LTD. (KR) | 2004-06-08 | — | — | US | disclosed |