Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | REN | P00797 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | CASP9 | P55211 | 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 | |
|---|---|---|---|---|
| SCHEMBL3988196 | 0.79 | CA2 (0.42) | CASP3CASP7MEN1KMT2ACASP1 | |
| SCHEMBL3989682 | 0.76 | TACR1 (0.48) | MEN1KMT2ACTSLCTSBCTSS | |
| SCHEMBL3987520 | 0.73 | CTSL (0.41) | CASP3CASP7MEN1KMT2ACTSL | |
| SCHEMBL8815629 | 0.72 | CTSB (0.62) | CASP3CASP7RENCTSLCTSB | |
| SCHEMBL8815632 | 0.72 | CTSB (0.62) | CASP3CASP7RENCTSLCTSB | |
| SCHEMBL5686625 | 0.71 | CTSB (0.57) | CASP3CASP7RENCTSLCTSB | |
| SCHEMBL3989402 | 0.70 | — | — | |
| SCHEMBL7788731 | 0.69 | CA4 (0.41) | CASP3CASP7CTSLCTSBCTSS | |
| SCHEMBL23447154 | 0.67 | CTSS (0.54) | RENCTSLCTSBCTSSCTSK | |
| SCHEMBL3987548 | 0.67 | ERCC1 (0.30) | RENCTSLCTSSCTSK |
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 |
|---|---|---|---|---|---|---|---|
| US-7553969-B1 | Substituted phenethylamine derivatives | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2009-06-30 | — | — | US | disclosed |
| EP-1149843-A1 | SUBSTITUTED PHENETHYLAMINE DERIVATIVES | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2001-10-31 | — | — | EP | disclosed |