Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 4/20 | 0.53 |
| ▸ | CTSK | P43235 | 3/20 | 0.53 |
| ▸ | CTSL | P07711 | 1/20 | 0.53 |
| ▸ | CTSB | P07858 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | SYK | P43405 | 1/20 | 0.52 |
| ▸ | PTPRB | P23467 | 2/20 | 0.51 |
| ▸ | AKT1 | P31749 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | ACE | P12821 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | MME | P08473 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | ANPEP | P15144 | 1/20 | 0.45 |
| ▸ | ECE1 | P42892 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6600193 | 0.88 | CTSS (0.52) | CTSSCTSKCTSLCTSBATM | |
| SCHEMBL825959 | 0.88 | ATM (0.55) | CTSSCTSKCTSLCTSBATM | |
| SCHEMBL3825012 | 0.88 | ATM (0.55) | CTSSCTSKCTSLCTSBATM | |
| SCHEMBL1186455 | 0.88 | ATM (0.55) | CTSSCTSKCTSLCTSBATM | |
| SCHEMBL13816316 | 0.85 | SYK (0.56) | CTSSCTSKCTSLCTSBATM | |
| SCHEMBL1185840 | 0.83 | SYK (0.57) | CTSSCTSKCTSLCTSBATM | |
| SCHEMBL990687 | 0.83 | ANPEP (0.45) | CTSSCTSKCTSLCTSBATM | |
| SCHEMBL21974545 | 0.82 | SYK (0.56) | CTSSCTSKCTSLCTSBATM | |
| SCHEMBL13300083 | 0.82 | CTSS (0.51) | CTSSCTSKCTSLCTSBATM | |
| SCHEMBL13114024 | 0.81 | ATM (0.61) | CTSSCTSKCTSLCTSBATM |
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 |
|---|---|---|---|---|---|---|---|
| EP-2456762-A1 | DUAL-ACTING OXAZOLE ANTIHYPERTENSIVE AGENTS | Theravance, Inc. (US) | 2012-05-30 | — | — | EP | disclosed |
| WO-2011011232-A1 | DUAL-ACTING OXAZOLE ANTIHYPERTENSIVE AGENTS | THERAVANCE, INC. (US) | 2011-01-27 | — | — | WO | disclosed |