Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 5/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 2/20 | 0.41 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL15966524 | 0.91 | PTPN1 (0.42) | PTPN1PIN1CTSK | |
| SCHEMBL17350419 | 0.83 | CTSK (0.41) | CTSKCTSB | |
| SCHEMBL30375087 | 0.79 | CTSK (0.53) | PTPN1CASP3CTSKCTSB | |
| SCHEMBL4249277 | 0.77 | KMT2A (0.43) | — | |
| SCHEMBL3783542 | 0.77 | KMT2A (0.43) | — | |
| SCHEMBL3788777 | 0.77 | KMT2A (0.43) | — | |
| SCHEMBL3789335 | 0.77 | KMT2A (0.43) | — | |
| SCHEMBL3793423 | 0.77 | KMT2A (0.43) | — | |
| SCHEMBL17020400 | 0.76 | PIN1 (0.49) | PIN1CASP3 | |
| SCHEMBL29531966 | 0.76 | PTPN1 (0.53) | PTPN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2957555-A1 | METHOD FOR MODIFYING DERIVATIVES OF AMINO ACIDS AND PEPTIDES, COMPOUNDS PRODUCED, AND USE | Consejo Superior De Investigaciones Científicas (CSIC) (ES) | 2015-12-23 | — | — | EP | disclosed |
| EP-2957555-A1 | METHOD FOR MODIFYING DERIVATIVES OF AMINO ACIDS AND PEPTIDES, COMPOUNDS PRODUCED, AND USE | Consejo Superior De Investigaciones Científicas (CSIC) (ES) | 2015-12-23 | — | — | EP | disclosed |
| WO-2014125145-A1 | METHOD FOR MODIFYING DERIVATIVES OF AMINO ACIDS AND PEPTIDES, COMPOUNDS PRODUCED, AND USE | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) | 2014-08-21 | — | — | WO | disclosed |