Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL14437986 | 0.78 | CCR1 (0.35) | — | |
| SCHEMBL10222342 | 0.74 | GAA (0.38) | PARP1GAA | |
| SCHEMBL16891614 | 0.72 | — | — | |
| SCHEMBL16181350 | 0.70 | PARP1 (0.32) | PARP1GAA | |
| SCHEMBL31344848 | 0.69 | DYRK1A (0.33) | — | |
| SCHEMBL20674050 | 0.69 | — | — | |
| SCHEMBL23437864 | 0.69 | MEN1 (0.33) | PARP1MEN1ALDH1A1GAAKMT2A | |
| SCHEMBL21958567 | 0.69 | MEN1 (0.30) | MEN1ALDH1A1GAAKMT2A | |
| SCHEMBL20466121 | 0.69 | NOTUM (0.30) | — | |
| SCHEMBL31354644 | 0.69 | CYP2A6 (0.32) | MEN1ALDH1A1GAAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2877470-B1 | BICYCLIC AZA-AMIDES FOR TREATMENT OF PSYCHIATRIC DISORDERS | MAX-PLANCK-GESELLSCHAFT ZUR FÖRDERUNG DER WSS E V (DE) | 2017-09-13 | — | — | EP | disclosed |