Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGB | P11216 | 1/20 | 0.69 |
| ▸ | ECE1 | P42892 | 6/20 | 0.67 |
| ▸ | ERAP2 | Q6P179 | 4/20 | 0.66 |
| ▸ | ANPEP | P15144 | 3/20 | 0.66 |
| ▸ | ERAP1 | Q9NZ08 | 3/20 | 0.66 |
| ▸ | ACE | P12821 | 2/20 | 0.63 |
| ▸ | IL1RN | P18510 | 2/20 | 0.58 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL17813732 | 1.00 | PYGB (0.69) | PYGBECE1ERAP2ANPEPERAP1 | |
| SCHEMBL7321746 | 0.90 | LTA4H (0.63) | ECE1ERAP2ANPEPERAP1ACE | |
| SCHEMBL7306489 | 0.89 | ERAP2 (0.68) | PYGBECE1ERAP2ANPEPERAP1 | |
| SCHEMBL7321552 | 0.89 | ACE (0.67) | ECE1ERAP2ANPEPERAP1ACE | |
| SCHEMBL7315009 | 0.87 | ERAP2 (0.64) | PYGBECE1ERAP2ANPEPERAP1 | |
| SCHEMBL12433272 | 0.85 | GHSR (0.59) | ECE1ERAP2ANPEPERAP1ACE | |
| SCHEMBL12511244 | 0.85 | GHSR (0.59) | ECE1ERAP2ANPEPERAP1ACE | |
| SCHEMBL13853026 | 0.85 | GHSR (0.59) | ECE1ERAP2ANPEPERAP1ACE | |
| SCHEMBL29376293 | 0.85 | ACE (0.61) | ECE1ERAP2ANPEPERAP1ACE | |
| SCHEMBL12433274 | 0.85 | GHSR (0.59) | ECE1ERAP2ANPEPERAP1ACE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4472380-A | CARBOXYALKYL DIPEPTIDE DERIVATIVES | MERCK & CO., INC. (US) | 1984-09-18 | — | — | US | disclosed |
| US-4374829-A | Aminoacid derivatives as antihypertensives | MERCK & CO., INC. (US) | 1983-02-22 | — | — | US | disclosed |
| EP-0012401-A1 | Carboxyalkyl dipeptide derivatives, process for preparing them and pharmaceutical composition containing them | MERCK & CO. INC. (US) | 1980-06-25 | — | — | EP | disclosed |