Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 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 | |
|---|---|---|---|---|
| SCHEMBL13464578 | 0.94 | CYP1A2 (0.33) | CYP1A2ALDH1A1 | |
| SCHEMBL22341263 | 0.82 | CYP1A2 (0.37) | CYP1A2 | |
| SCHEMBL3541280 | 0.82 | CYP1A2 (0.37) | CYP1A2ALDH1A1 | |
| SCHEMBL11359306 | 0.82 | CYP1A2 (0.34) | CYP1A2 | |
| SCHEMBL18063203 | 0.80 | DPP4 (0.35) | CYP1A2 | |
| SCHEMBL29603054 | 0.80 | CYP1A2 (0.34) | CYP1A2FFAR3 | |
| SCHEMBL6061037 | 0.80 | CYP1A2 (0.34) | CYP1A2ALDH1A1FFAR3 | |
| SCHEMBL3865460 | 0.78 | CYP1A2 (0.33) | CYP1A2ALDH1A1 | |
| SCHEMBL6215052 | 0.78 | CYP1A2 (0.33) | CYP1A2ALDH1A1 | |
| SCHEMBL13464531 | 0.78 | ARG1 (0.35) | CYP1A2ALDH1A1 |
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-2014151367-A1 | 1,2,5-SUBSTITUTED BENZIMIDAZOLES AS FLAP MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2014-09-25 | — | — | WO | disclosed |