Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 3/20 | 0.49 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.43 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31098370 | 0.96 | CASP3 (0.47) | CASP3PIN1KMT2A | |
| SCHEMBL31488367 | 0.92 | CASP3 (0.43) | CASP3PIN1KMT2A | |
| Hydrochloric Acid SCHEMBL30261623 | 0.89 | CASP3 (0.45) | CASP3CTSB | |
| SCHEMBL30582698 | 0.87 | CASP3 (0.54) | CASP3PIN1KMT2ACTSLCTSB | |
| SCHEMBL31453529 | 0.87 | CASP3 (0.45) | CASP3PIN1KMT2ACTSLCTSB | |
| SCHEMBL25213324 | 0.87 | KMT2A (0.49) | CASP3PIN1KMT2A | |
| SCHEMBL30474403 | 0.87 | KMT2A (0.49) | CASP3PIN1KMT2A | |
| SCHEMBL25268021 | 0.87 | KMT2A (0.49) | CASP3PIN1KMT2A | |
| SCHEMBL31251126 | 0.85 | CASP3 (0.51) | CASP3PIN1KMT2ACTSLCTSB | |
| SCHEMBL28522099 | 0.85 | CASP3 (0.48) | CASP3PIN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-117924161-A | Preparation of pH response type artificial channel with high selectivity for inhibiting growth of intestinal cancer cell HCT116 | 厦门大学 | 2024-04-26 | — | — | CN | disclosed |