Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 4/20 | 0.54 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.47 |
| ▸ | CPA1 | P15085 | 1/20 | 0.43 |
| ▸ | CPA2 | P48052 | 1/20 | 0.43 |
| ▸ | CPA4 | Q9UI42 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 2/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.42 |
| ▸ | CASP9 | P55211 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14370014 | 0.83 | CASP1 (0.60) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL9572115 | 0.83 | CASP1 (0.52) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL2314756 | 0.82 | CASP1 (0.61) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL2314769 | 0.82 | CASP1 (0.61) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL646595 | 0.82 | CASP1 (0.55) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL24310822 | 0.81 | CASP1 (0.63) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL7702992 | 0.81 | CASP1 (0.53) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL7752844 | 0.81 | CASP1 (0.55) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL5689768 | 0.81 | CASP1 (0.59) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL8028643 | 0.80 | CASP1 (0.59) | CASP1GRIA1CPA1CPA2CPA4 |
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-0784628-A1 | INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME | Vertex Pharmaceuticals Incorporated (US) | 1997-07-23 | — | — | EP | disclosed |
| WO-1995035308-A1 | INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME | VERTEX PHARMACEUTICALS INCORPORATED (US) | 1995-12-28 | — | — | WO | disclosed |