Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 6/20 | 0.52 |
| ▸ | CASP1 | P29466 | 5/20 | 0.52 |
| ▸ | CASP7 | P55210 | 5/20 | 0.52 |
| ▸ | CASP6 | P55212 | 5/20 | 0.52 |
| ▸ | CASP8 | Q14790 | 5/20 | 0.52 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.42 |
| ▸ | ANPEP | P15144 | 2/20 | 0.41 |
| ▸ | MME | P08473 | 1/20 | 0.38 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
| ▸ | CPA1 | P15085 | 1/20 | 0.38 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.38 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.38 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.38 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7622869 | 1.00 | CASP3 (0.52) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7627735 | 0.88 | CASP3 (0.57) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7619325 | 0.88 | CASP3 (0.57) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7420035 | 0.88 | CASP3 (0.57) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7413527 | 0.88 | CASP3 (0.57) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7467278 | 0.86 | CASP3 (0.53) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7672483 | 0.82 | ANPEP (0.48) | PSMB5NTSR1ANPEPMMEACE | |
| SCHEMBL7625305 | 0.82 | ANPEP (0.48) | PSMB5NTSR1ANPEPMMEACE | |
| SCHEMBL5488516 | 0.80 | CASP3 (0.55) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL5971546 | 0.73 | CAPN1 (0.46) | — |
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-1123272-A1 | (SUBSTITUTED)ACYL DIPEPTIDYL INHIBITORS OF THE ICE/CED-3 FAMILY OF CYSTEINE PROTEASES | Idun Pharmaceuticals, Inc. (US) | 2001-08-16 | — | — | EP | disclosed |
| WO-2000023421-A1 | (SUBSTITUTED)ACYL DIPEPTIDYL INHIBITORS OF THE ICE/ced-3 FAMILY OF CYSTEINE PROTEASES | IDUN PHARMACEUTICALS, INC. (US) | 2000-04-27 | — | — | WO | disclosed |