Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 4/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | MDM4 | O15151 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL29697630 | 1.00 | CASP3 (0.41) | CASP3CTSLCTSBCTSSCTSK | |
| SCHEMBL29696725 | 0.90 | CASP3 (0.38) | CASP3CTSLCTSBCTSSCTSK | |
| SCHEMBL31355420 | 0.86 | CASP3 (0.49) | CASP3CTSLCTSBCTSSMDM4 | |
| SCHEMBL29051485 | 0.86 | CASP3 (0.49) | CASP3CTSLCTSBCTSSMDM4 | |
| SCHEMBL29696609 | 0.83 | CASP3 (0.46) | CASP3CTSLCTSBCTSSCTSK | |
| SCHEMBL24579343 | 0.83 | CASP3 (0.42) | CASP3CTSLCTSBCTSSCTSK | |
| SCHEMBL30640779 | 0.83 | CASP3 (0.42) | CASP3CTSLCTSBCTSSCTSK | |
| SCHEMBL24579232 | 0.83 | CTSK (0.41) | CASP3CTSLCTSBCTSSCTSK | |
| SCHEMBL24579233 | 0.83 | CTSK (0.41) | CASP3CTSLCTSBCTSSCTSK | |
| SCHEMBL29697651 | 0.83 | CTSK (0.41) | CASP3CTSLCTSBCTSSCTSK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022138891-A1 | METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE | 中外製薬株式会社 | 2022-06-30 | — | — | WO | disclosed |