Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | MDM4 | O15151 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.37 |
| ▸ | CASP3 | P42574 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30196401 | 0.91 | MDM4 (0.41) | EGFRSRCMDM4TP53MDM2 | |
| SCHEMBL30196553 | 0.90 | MDM4 (0.38) | EGFRSRCMDM4TP53MDM2 | |
| SCHEMBL30196287 | 0.89 | MDM2 (0.44) | EGFRSRCMDM4TP53MDM2 | |
| SCHEMBL30196138 | 0.88 | MDM4 (0.37) | EGFRSRCMDM4TP53MDM2 | |
| SCHEMBL30196119 | 0.83 | EPHX2 (0.36) | EGFRSRCMDM4TP53MDM2 | |
| SCHEMBL30196213 | 0.77 | EGFR (0.47) | EGFRSRCALDH1A1 | |
| SCHEMBL18795729 | 0.75 | MDM4 (0.51) | MDM4TP53MDM2CASP3 | |
| SCHEMBL850332 | 0.75 | MDM4 (0.51) | MDM4TP53MDM2CASP3 | |
| SCHEMBL30229529 | 0.75 | MDM4 (0.51) | MDM4TP53MDM2CASP3 | |
| SCHEMBL30229718 | 0.75 | MDM4 (0.51) | MDM4TP53MDM2CASP3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023001999-A1 | C2-THIOETHER TRYPTOPHAN TRIMERS AND TETRAMERS FOR THE TREATMENT OF BETACORONOAVIRUS INFECTIONS | 1. CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) | 2023-01-26 | — | — | WO | disclosed |
| EP-4122917-A1 | C2-THIOETHER TRYPTOPHAN TRIMERS AND TETRAMERS AND USE THEREOF | Consejo Superior de Investigaciones Científicas (CSIC) (ES) | 2023-01-25 | — | — | EP | disclosed |