Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.64 |
| ▸ | PNMT | P11086 | 1/20 | 0.48 |
| ▸ | CTSS | P25774 | 5/20 | 0.47 |
| ▸ | CTSK | P43235 | 4/20 | 0.47 |
| ▸ | CTSB | P07858 | 3/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.46 |
| ▸ | ACE | P12821 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | KLK5 | Q9Y337 | 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 | |
|---|---|---|---|---|
| SCHEMBL9627603 | 0.88 | MAOB (0.56) | CTSLSLC2A1 | |
| SCHEMBL14991354 | 0.86 | PNMT (0.53) | CTSLPNMTCTSSCTSKCTSB | |
| SCHEMBL2141200 | 0.85 | CTSS (0.48) | CTSLCTSSCTSKCTSBATM | |
| SCHEMBL2141206 | 0.85 | CTSS (0.48) | CTSLCTSSCTSKCTSBATM | |
| SCHEMBL23900516 | 0.85 | JAK2 (0.50) | CTSLCTSSCTSKCTSBATM | |
| SCHEMBL30461919 | 0.85 | CTSL (0.74) | CTSLCTSSCTSKCTSBACE | |
| SCHEMBL13905628 | 0.85 | CTSL (0.61) | CTSLPNMTCTSSCTSKCTSB | |
| SCHEMBL3553561 | 0.85 | CTSL (0.74) | CTSLCTSSCTSKCTSBACE | |
| SCHEMBL1519629 | 0.85 | CTSL (0.74) | CTSLCTSSCTSKCTSBACE | |
| SCHEMBL1519627 | 0.85 | CTSL (0.74) | CTSLCTSSCTSKCTSBACE |
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 |
|---|---|---|---|---|---|---|---|
| EP-3262026-B1 | NEW TRIFLUOROMETHYLPROPANAMIDE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2020-03-18 | — | — | EP | disclosed |