Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 5/20 | 0.57 |
| ▸ | CASP1 | P29466 | 4/20 | 0.57 |
| ▸ | CASP7 | P55210 | 4/20 | 0.57 |
| ▸ | CASP6 | P55212 | 4/20 | 0.57 |
| ▸ | CASP8 | Q14790 | 4/20 | 0.57 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.48 |
| ▸ | ERAP2 | Q6P179 | 5/20 | 0.43 |
| ▸ | IL1RN | P18510 | 4/20 | 0.40 |
| ▸ | ERAP1 | Q9NZ08 | 3/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.38 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | FOLH1 | Q04609 | 4/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7627735 | 1.00 | CASP3 (0.57) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7413527 | 1.00 | CASP3 (0.57) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7619325 | 1.00 | CASP3 (0.57) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7416213 | 0.88 | CASP3 (0.52) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7622869 | 0.88 | CASP3 (0.52) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL5494420 | 0.82 | CASP1 (0.60) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL5496384 | 0.82 | CASP1 (0.60) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL14598380 | 0.82 | CASP1 (0.60) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL14598379 | 0.82 | CASP1 (0.60) | CASP3CASP1CASP7CASP6CASP8 | |
| SCHEMBL7467278 | 0.82 | CASP3 (0.53) | CASP3CASP1CASP7CASP6CASP8 |
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 |