Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 3/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 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 | |
|---|---|---|---|---|
| SCHEMBL16482913 | 0.84 | PTPN1 (0.42) | PTPN1CASP3PIN1CTSLCTSB | |
| SCHEMBL29351900 | 0.79 | CASP3 (0.49) | PTPN1CASP3KMT2A | |
| SCHEMBL30448102 | 0.79 | CASP3 (0.49) | PTPN1CASP3KMT2A | |
| SCHEMBL7391232 | 0.78 | PTPN1 (0.46) | PTPN1CASP3CTSLCTSBCTSK | |
| SCHEMBL7391230 | 0.78 | PTPN1 (0.46) | PTPN1CASP3CTSLCTSBCTSK | |
| SCHEMBL10175069 | 0.75 | PTPN1 (0.46) | PTPN1CTSLCTSK | |
| SCHEMBL14645111 | 0.75 | PTPN1 (0.46) | PTPN1CTSLCTSK | |
| SCHEMBL29670135 | 0.75 | CASP3 (0.44) | PTPN1CASP3CTSLCTSK | |
| SCHEMBL16075059 | 0.74 | PTPN1 (0.49) | PTPN1CTSLCTSK | |
| SCHEMBL117946 | 0.74 | MDM4 (0.51) | PTPN1CASP3CTSLCTSK |
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-5811548-A | USEFUL AS RESEARCH TOOLS IN THE DETERMINATION OF BIOLOGICALLY ACTIVE PEPTIDE SEQUENCES | HOFFMANN-LA ROCHE INC. (US) | 1998-09-22 | — | — | US | disclosed |