Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 16/20 | 0.55 |
| ▸ | MME | P08473 | 14/20 | 0.55 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.52 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP14 | P50281 | 1/20 | 0.47 |
| ▸ | KYNU | Q16719 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9715281 | 0.86 | ACE2 (0.62) | ECE1MMEACE2KYNU | |
| SCHEMBL9715088 | 0.85 | ECE1 (0.60) | ECE1MMEACE2MMP8MMP14 | |
| SCHEMBL9697199 | 0.85 | ACE2 (0.70) | ECE1MMEACE2MMP8MMP14 | |
| SCHEMBL9697689 | 0.83 | KYNU (0.47) | ECE1MMEACE2KYNU | |
| SCHEMBL9715090 | 0.82 | MMP8 (0.64) | ECE1MMEACE2MMP8MMP14 | |
| SCHEMBL9715136 | 0.82 | ACE2 (0.69) | ECE1MMEACE2 | |
| SCHEMBL9698581 | 0.82 | ACE2 (0.58) | ECE1MMEACE2MMP8MMP14 | |
| SCHEMBL8276699 | 0.78 | SIRT2 (0.55) | KYNU | |
| SCHEMBL6928745 | 0.78 | ECE1 (0.77) | ECE1MMEACE2MMP8MMP14 | |
| SCHEMBL9698508 | 0.78 | MMP8 (0.59) | ECE1MMEACE2MMP8MMP14 |
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 |
|---|---|---|---|---|---|---|---|
| US-5143908-A | Carboxylic acids containing amino and phosphinyl groups | MERCK & CO., INC. (US) | 1992-09-01 | — | — | US | disclosed |
| US-5099063-A | 3-(1-aminoalkylphosphinyl)-(2-substituted)propionic acids | MERCK & CO., INC. (US) | 1992-03-24 | — | — | US | disclosed |
| EP-0266978-A2 | Novel antibacterial agents and potentiators of carbapenem antibiotics | MERCK & CO. INC. (US) | 1988-05-11 | — | — | EP | disclosed |
| US-4715994-A | PHOSPHINIC ACID DERIVATIVES | MERCK & CO., INC. (US) | 1987-12-29 | — | — | US | disclosed |