Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 8/20 | 0.81 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.70 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.70 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.70 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.69 |
| ▸ | MME | P08473 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL10853559 | 1.00 | ACE (0.81) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL10855240 | 1.00 | ACE (0.81) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL10853549 | 1.00 | ACE (0.81) | ACEABCB11AGTR2PDE3ATDP1 | |
| Hydrochloric Acid SCHEMBL11013211 | 0.99 | ACE (0.80) | ACEABCB11AGTR2PDE3ATDP1 | |
| Hydrochloric Acid SCHEMBL9824878 | 0.99 | ACE (0.80) | ACEABCB11AGTR2PDE3ATDP1 | |
| Hydrochloric Acid SCHEMBL10856588 | 0.99 | ACE (0.80) | ACEABCB11AGTR2PDE3ATDP1 | |
| Hydrochloric Acid SCHEMBL9824873 | 0.99 | ACE (0.80) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL10856359 | 0.96 | ACE (0.74) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL10856344 | 0.96 | ACE (0.74) | ACEABCB11AGTR2PDE3ATDP1 | |
| SCHEMBL11012582 | 0.94 | ACE (0.71) | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4539150-A | HYPOTENSIVE AGENTS, SULFIDING, CYCLIZATION | MITSUI TOATSU CHEMICALS, INC. (JP) | 1985-09-03 | — | — | US | claimed |
| US-4477464-A | Hetero-benzazepine derivatives and their pharmaceutical use | CIBA-GEIGY CORPORATION (US) | 1984-10-16 | — | — | US | claimed |
| US-4539150-A | HYPOTENSIVE AGENTS, SULFIDING, CYCLIZATION | MITSUI TOATSU CHEMICALS, INC. (JP) | 1985-09-03 | — | — | US | disclosed |
| EP-0120728-A1 | Thiazine and thiazepine containing compounds | E.R. Squibb & Sons, Inc. (US) | 1984-10-03 | — | — | EP | disclosed |