Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 9/20 | 0.59 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.59 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.59 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | MME | P08473 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL7292113 | 1.00 | ACE (0.59) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL7283705 | 0.91 | ACE (0.70) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL7283700 | 0.91 | ACE (0.70) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL7292794 | 0.91 | ACE (0.70) | ACEABCB11AGTR2PDE3ATDP1 | |
| Hydrochloric Acid SCHEMBL7281829 | 0.90 | KDM4E (0.71) | ACEABCB11AGTR2PDE3ATDP1 | |
| Hydrochloric Acid SCHEMBL7289829 | 0.90 | KDM4E (0.71) | ACEABCB11AGTR2PDE3ATDP1 | |
| Hydrochloric Acid SCHEMBL7281822 | 0.90 | KDM4E (0.71) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL11071678 | 0.88 | ACE (0.61) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL8873232 | 0.87 | ACE (0.56) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL8873239 | 0.87 | ACE (0.56) | ACEABCB11AGTR2PDE3ATDP1 |
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-4591458-A | ENZYME INHIBITORS; HYPOTENSIVE AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1986-05-27 | — | — | US | disclosed |
| US-4548932-A | ANGIOTENSIN INHIBITOR, HYPOTENSIVE AGENT | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1985-10-22 | — | — | US | disclosed |
| EP-0135349-A1 | Condensed seven-membered ring compounds and their production and use | Takeda Chemical Industries, Ltd. (JP) | 1985-03-27 | — | — | EP | disclosed |