Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 2/20 | 0.44 |
| ▸ | MDM4 | O15151 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | SRC | P12931 | 2/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 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) | MDM2MDM4TP53SRCEGFR | |
| SCHEMBL30196023 | 0.89 | EGFR (0.39) | MDM2MDM4TP53SRCEGFR | |
| SCHEMBL30196553 | 0.88 | MDM4 (0.38) | MDM2MDM4TP53SRCEGFR | |
| SCHEMBL30196138 | 0.87 | MDM4 (0.37) | MDM2MDM4TP53SRCEGFR | |
| SCHEMBL30196119 | 0.82 | EPHX2 (0.36) | MDM2MDM4TP53SRCEGFR | |
| SCHEMBL30196235 | 0.78 | EGFR (0.46) | TP53SRCEGFR | |
| SCHEMBL850790 | 0.75 | MDM4 (0.42) | MDM2MDM4TP53SRCEGFR | |
| SCHEMBL31671078 | 0.74 | MDM4 (0.46) | MDM2MDM4TP53CASP3 | |
| SCHEMBL18795729 | 0.73 | MDM4 (0.51) | MDM2MDM4TP53CASP3 | |
| SCHEMBL850332 | 0.73 | MDM4 (0.51) | MDM2MDM4TP53CASP3 |
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 |