Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 2/20 | 0.35 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 3/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9737978 | 0.93 | AGTR1 (0.34) | AGTR1AGTR2MGLLFAAHALDH1A1 | |
| SCHEMBL9738129 | 0.92 | AGTR1 (0.35) | AGTR1AGTR2 | |
| SCHEMBL9739512 | 0.91 | AGTR1 (0.33) | AGTR1AGTR2MGLLFAAHALDH1A1 | |
| SCHEMBL9738516 | 0.90 | AGTR1 (0.36) | AGTR1AGTR2 | |
| SCHEMBL9738276 | 0.89 | AGTR1 (0.38) | AGTR1AGTR2 | |
| SCHEMBL9738653 | 0.88 | TRPV1 (0.35) | ALDH1A1 | |
| SCHEMBL9738503 | 0.87 | TRPV1 (0.36) | ALDH1A1 | |
| SCHEMBL9738294 | 0.84 | AGTR1 (0.43) | AGTR1 | |
| SCHEMBL9739869 | 0.84 | AGTR1 (0.36) | AGTR1 | |
| SCHEMBL9738675 | 0.84 | SLC33A1 (0.36) | AGTR1AGTR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1992005161-A1 | 1,3,5-TRISUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS | G.D. SEARLE & CO. (US) | 1992-04-02 | — | — | WO | claimed |
| WO-1992005161-A1 | 1,3,5-TRISUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS | G.D. SEARLE & CO. (US) | 1992-04-02 | — | — | WO | disclosed |