Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | KIT | P10721 | 1/20 | 0.30 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7992171 | 0.90 | CYP11B1 (0.35) | ALDH1A1CYP11B2CYP11B1 | |
| SCHEMBL7979711 | 0.88 | HSD11B1 (0.36) | ALDH1A1 | |
| SCHEMBL7981848 | 0.85 | ALDH1A1 (0.33) | ALDH1A1CYP11B2KITCYP11B1 | |
| SCHEMBL7982146 | 0.85 | CYP11B1 (0.32) | ALDH1A1CYP11B2CYP11B1 | |
| SCHEMBL7979761 | 0.85 | OPRM1 (0.37) | ALDH1A1 | |
| SCHEMBL7978100 | 0.85 | HSD11B1 (0.33) | ALDH1A1CYP11B2CYP11B1 | |
| SCHEMBL12671356 | 0.85 | PDE4A (0.35) | CYP11B2CYP11B1 | |
| SCHEMBL7981764 | 0.84 | HSD11B1 (0.33) | ALDH1A1 | |
| SCHEMBL7977941 | 0.81 | HSD11B1 (0.35) | ALDH1A1CYP11B2CYP11B1 | |
| SCHEMBL7968275 | 0.81 | HSD11B2 (0.39) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010001946-A1 | TRIAZOLE DERIVATIVE OR SALT THEREOF | アステラス製薬株式会社 (JP) | 2010-01-07 | — | — | WO | disclosed |