Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 8/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | MME | P08473 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.42 |
| ▸ | CPA1 | P15085 | 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 | |
|---|---|---|---|---|
| SCHEMBL25382819 | 1.00 | CAPN1 (0.47) | CAPN1ALDH1A1CTSBMMEACE | |
| SCHEMBL2267800 | 0.85 | TDP1 (0.43) | CAPN1CTSB | |
| SCHEMBL2268714 | 0.85 | TDP1 (0.43) | CAPN1CTSB | |
| SCHEMBL2369340 | 0.84 | CAPN1 (0.61) | CAPN1CTSBACE | |
| SCHEMBL3292711 | 0.84 | CAPN1 (0.61) | CAPN1CTSBACE | |
| SCHEMBL17865652 | 0.84 | CAPN1 (0.61) | CAPN1CTSBACE | |
| SCHEMBL18577183 | 0.83 | CAPN1 (0.47) | CAPN1ALDH1A1CTSBMMEACE | |
| SCHEMBL6344818 | 0.83 | CAPN1 (0.40) | CAPN1CTSBACE | |
| SCHEMBL18577180 | 0.83 | CAPN1 (0.47) | CAPN1ALDH1A1CTSBMMEACE | |
| SCHEMBL16932220 | 0.82 | CAPN1 (0.52) | CAPN1CTSBMMEACECPA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023165334-A1 | KETO AMIDE DERIVATIVES AND PHARMACEUTICAL USE THEREOF | 成都威斯克生物医药有限公司 | 2023-09-07 | — | — | WO | disclosed |
| WO-2018165520-A1 | METALLOENZYME INHIBITOR COMPOUNDS | VPS-3, INC. (US) | 2018-09-13 | — | — | WO | disclosed |
| 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 |