Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 4/20 | 0.65 |
| ▸ | YAP1 | P46937 | 3/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | ACE | P12821 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7276597 | 1.00 | POLB (0.65) | POLBYAP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7373547 | 0.89 | YAP1 (0.59) | POLBYAP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6165579 | 0.85 | MAPK1 (0.75) | POLBYAP1MAPK1KMT2AALDH1A1 | |
| SCHEMBL6165580 | 0.85 | MAPK1 (0.75) | POLBYAP1MAPK1KMT2AALDH1A1 | |
| SCHEMBL9558248 | 0.85 | MAPK1 (0.58) | YAP1MAPK1ACE | |
| SCHEMBL9417257 | 0.83 | POLB (0.67) | POLBYAP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7284800 | 0.82 | POLB (0.61) | POLBYAP1MAPK1KMT2AACE | |
| SCHEMBL27230807 | 0.82 | POLB (0.74) | POLBCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7266885 | 0.82 | POLB (0.74) | POLBCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7350808 | 0.82 | YAP1 (0.54) | YAP1MAPK1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0314239-A2 | Tripeptide renin inhibitors with N-terminal ureido or sulfamido groups | MERCK & CO. INC. (US) | 1989-05-03 | — | — | EP | disclosed |
| EP-0312157-A2 | Tetrapeptide renin inhibitors having a novel c-terminal amino acid | MERCK & CO. INC. (US) | 1989-04-19 | — | — | EP | disclosed |
| EP-0312158-A2 | Tetrapeptide renin inhibitors having novel c-terminal amino acid amide | MERCK & CO. INC. (US) | 1989-04-19 | — | — | EP | disclosed |