Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 2/20 | 0.53 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.47 |
| ▸ | CPA1 | P15085 | 1/20 | 0.45 |
| ▸ | CPA2 | P48052 | 1/20 | 0.45 |
| ▸ | CPA4 | Q9UI42 | 1/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | REN | P00797 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.41 |
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 | 0.85 | CASP1 (0.60) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL2314756 | 0.84 | CASP1 (0.61) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL2314769 | 0.84 | CASP1 (0.61) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL646595 | 0.84 | CASP1 (0.55) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL24310822 | 0.83 | CASP1 (0.63) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL7752844 | 0.83 | CASP1 (0.55) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL9559471 | 0.83 | GRIA1 (0.50) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL5689768 | 0.82 | CASP1 (0.59) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL8764076 | 0.81 | CASP1 (0.54) | CASP1GRIA1CPA1CPA2CPA4 | |
| SCHEMBL30031739 | 0.81 | CASP1 (0.55) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6348570-B1 | TETRAPEPTIDES; DIAGNOSING AND MONITORING INFLAMMATORY, NERVOUS SYSTEM, SKIN, CARDIOVASCULAR, RESPIRATORY SYSTEM, GASTROINTESTINAL, UROGENITAL AND IMMUNE DISORDERS; EVALUATING INHIBITORS | MERCK & CO., INC. | 2002-02-19 | — | — | US | disclosed |