Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 8/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11077404 | 0.86 | BACE1 (0.32) | BACE1 | |
| SCHEMBL11078496 | 0.84 | BRD4 (0.36) | BRD4SLC6A4SLC6A3SLC6A2SRD5A1 | |
| SCHEMBL11075393 | 0.81 | BRD4 (0.37) | BRD4SRD5A1SRD5A2 | |
| SCHEMBL11087497 | 0.79 | BRD4 (0.38) | BRD4SLC6A4SLC6A3SLC6A2SRD5A1 | |
| SCHEMBL11080957 | 0.78 | BRD4 (0.37) | BRD4SLC6A4SLC6A3SLC6A2SRD5A1 | |
| SCHEMBL11076487 | 0.78 | BRD4 (0.37) | BRD4MAOASRD5A1SRD5A2 | |
| SCHEMBL11111651 | 0.78 | BRD4 (0.55) | BRD4SRD5A1SRD5A2 | |
| SCHEMBL11090881 | 0.78 | SRD5A1 (0.53) | BRD4SRD5A1 | |
| SCHEMBL11080446 | 0.78 | TSHR (0.41) | MAOABACE1 | |
| SCHEMBL11072826 | 0.77 | BRD4 (0.53) | BRD4SLC6A4SLC6A3SLC6A2SRD5A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0024776-B1 | 4-PHENYL AND 5-PHENYL-1,4,5,6-TETRAHYDROPYRIMIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES, AND PROCESS FOR PREPARING SAID DERIVATIVES | SYNTEX (U.S.A.) INC. (US) | 1984-12-27 | — | — | EP | disclosed |
| EP-0024776-A1 | 4-Phenyl and 5-phenyl-1,4,5,6-tetrahydropyrimidine derivatives, pharmaceutical compositions containing said derivatives, and process for preparing said derivatives | SYNTEX (U.S.A.) INC. (US) | 1981-03-11 | — | — | EP | disclosed |