Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | MME | P08473 | 18/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 17/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2390591 | 0.76 | AGTR1 (0.45) | ACHEMMEAGTR1 | |
| SCHEMBL2392577 | 0.75 | AGTR1 (0.43) | ACHEMMEAGTR1 | |
| SCHEMBL1257539 | 0.74 | MME (0.67) | MMEAGTR1 | |
| SCHEMBL1258808 | 0.73 | MME (0.68) | MMEAGTR1 | |
| SCHEMBL1258805 | 0.73 | MME (0.68) | MMEAGTR1 | |
| SCHEMBL1258405 | 0.68 | AGTR1 (0.63) | MMEAGTR1 | |
| SCHEMBL1258406 | 0.68 | AGTR1 (0.63) | MMEAGTR1 | |
| SCHEMBL1258461 | 0.67 | AGTR1 (0.70) | MMEAGTR1 | |
| SCHEMBL1258459 | 0.67 | AGTR1 (0.70) | MMEAGTR1 | |
| SCHEMBL1258515 | 0.66 | MME (0.57) | MMEAGTR1 |
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-2334651-A2 | DUAL-ACTING ANTIHYPERTENSIVE AGENTS | Theravance, Inc. (US) | 2011-06-22 | — | — | EP | disclosed |
| WO-2010011821-A2 | DUAL-ACTING ANTIHYPERTENSIVE AGENTS | THERAVANCE, INC. (US) | 2010-01-28 | — | — | WO | disclosed |