Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 10/20 | 0.42 |
| ▸ | GRB2 | P62993 | 2/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5686852 | 0.92 | OPRD1 (0.43) | CTSDOPRD1GRB2OPRM1OPRK1 | |
| SCHEMBL5688620 | 0.92 | OPRD1 (0.43) | CTSDOPRD1GRB2OPRM1OPRK1 | |
| SCHEMBL5686592 | 0.85 | OPRD1 (0.46) | OPRD1CASP1 | |
| SCHEMBL5686700 | 0.84 | OPRD1 (0.50) | OPRD1OPRM1OPRK1CASP1 | |
| SCHEMBL5686935 | 0.84 | OPRD1 (0.41) | CTSDOPRD1GRB2OPRM1OPRK1 | |
| SCHEMBL5687724 | 0.82 | OPRD1 (0.48) | OPRD1OPRM1OPRK1CASP1 | |
| SCHEMBL5686897 | 0.79 | CTSD (0.37) | CTSDOPRD1GRB2 | |
| SCHEMBL5689707 | 0.78 | NPY4R (0.44) | OPRD1OPRM1OPRK1 | |
| SCHEMBL5686954 | 0.77 | CTSD (0.44) | CTSDOPRD1OPRM1OPRK1 | |
| SCHEMBL5686675 | 0.77 | CASP1 (0.47) | OPRD1CASP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0979241-B1 | (3R)-3-AMINO-4-CARBOXYBUTYRALDEHYDE DERIVATIVES INHIBITING THE RELEASE OF INTERLEUKIN-1/BETA | IVAX DRUG RES INST LTD (HU) | 2006-03-01 | — | — | EP | disclosed |
| 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 |