Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | CTSD | P07339 | 3/20 | 0.37 |
| ▸ | REN | P00797 | 3/20 | 0.37 |
| ▸ | CASP1 | P29466 | 3/20 | 0.36 |
| ▸ | HLA-DRB1 | P01911 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 2/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 2/20 | 0.35 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | CASP9 | P55211 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5686897 | 0.86 | CTSD (0.37) | OPRD1CTSD | |
| SCHEMBL5689430 | 0.85 | OPRD1 (0.40) | OPRD1CTSDCASP1 | |
| SCHEMBL5686592 | 0.80 | OPRD1 (0.46) | OPRD1RENCASP1HLA-DRB1CASP3 | |
| SCHEMBL5686579 | 0.80 | CTSD (0.38) | OPRD1CTSD | |
| SCHEMBL7198017 | 0.79 | REN (0.46) | OPRD1CTSDRENCASP1HLA-DRB1 | |
| SCHEMBL5689425 | 0.76 | CASP1 (0.49) | OPRD1CTSDRENCASP1HLA-DRB1 | |
| SCHEMBL5686711 | 0.73 | CTSD (0.36) | OPRD1CTSDBACE1 | |
| SCHEMBL5686675 | 0.73 | CASP1 (0.47) | OPRD1RENCASP1CASP3CASP7 | |
| SCHEMBL5686901 | 0.72 | REN (0.46) | CTSDRENCASP1HLA-DRB1CTSS | |
| SCHEMBL5686703 | 0.72 | REN (0.42) | CTSDRENBACE1CTSK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6593300-B1 | Inhibitors of the interleukin-1 beta converting enzyme | GYOGYSZERKUTATO INTEZET KFT. (HU) | 2003-07-15 | — | — | US | disclosed |
| EP-0979241-A1 | (3R)-3-AMINO-4-CARBOXYBUTYRALDEHYDE DERIVATIVES INHIBITING THE RELEASE OF INTERLEUKIN-1/BETA | GYOGYSZERKUTATO INTEZET KFT. (HU) | 2000-02-16 | — | — | EP | disclosed |
| WO-1998049189-A1 | (3R)-3-AMINO-4-CARBOXYBUTYRALDEHYDE DERIVATIVES INHIBITING THE RELEASE OF INTERLEUKIN-1/BETA | Gyógyszerkutató Intézet Kft. (HU) | 1998-11-05 | — | — | WO | disclosed |