Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 9/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 9/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8109361 | 0.93 | AGTR1 (0.42) | TSHRAGTR1AGTR2 | |
| SCHEMBL8105634 | 0.92 | AGTR1 (0.49) | AGTR1AGTR2 | |
| SCHEMBL8095784 | 0.91 | AGTR1 (0.47) | TSHRAGTR1AGTR2PTGDR2 | |
| SCHEMBL8105696 | 0.91 | AGTR1 (0.50) | AGTR1AGTR2 | |
| SCHEMBL8111140 | 0.90 | AGTR1 (0.40) | TSHRAGTR1AGTR2 | |
| SCHEMBL8095811 | 0.89 | AGTR1 (0.38) | TSHRAGTR1AGTR2 | |
| SCHEMBL8095813 | 0.89 | AGTR1 (0.38) | TSHRAGTR1AGTR2 | |
| SCHEMBL8110955 | 0.89 | TSHR (0.38) | TSHRAGTR1AGTR2 | |
| SCHEMBL8105596 | 0.88 | AGTR1 (0.39) | TSHRAGTR1AGTR2 | |
| SCHEMBL8103591 | 0.88 | AGTR1 (0.39) | TSHRAGTR1AGTR2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3098772-B2 | — | — | 2000-10-16 | — | — | JP | claimed |
| EP-0527851-A1 | 1H-SUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1993-02-24 | — | — | EP | claimed |
| WO-1991017148-A1 | 1H-SUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1991-11-14 | — | — | WO | claimed |
| EP-0527851-A1 | 1H-SUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1993-02-24 | — | — | EP | disclosed |
| US-5098920-A | Hypotensive agents and treatment of congestive heart failure | G. D. SEARLE & CO. (US) | 1992-03-24 | — | — | US | disclosed |
| WO-1991017148-A1 | 1H-SUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1991-11-14 | — | — | WO | disclosed |