Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 9/20 | 0.45 |
| ▸ | PDE4A | P27815 | 5/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.45 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.45 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17696096 | 0.86 | HSD11B1 (0.51) | LRRK2MEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL17076877 | 0.85 | LRRK2 (0.51) | LRRK2KMT2APOLB | |
| SCHEMBL17696088 | 0.82 | ALDH1A1 (0.47) | MEN1KMT2AALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL22422608 | 0.80 | HSD11B1 (0.49) | PDE4DPDE4APDE4BPDE4CLRRK2 | |
| SCHEMBL15650740 | 0.79 | HSP90AA1 (0.46) | PDE4DPDE4APDE4BPDE4CLRRK2 | |
| SCHEMBL20750534 | 0.79 | KDM4E (0.44) | LRRK2MEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL17696095 | 0.79 | CA12 (0.48) | ALDH1A1HSD11B1LMNAGPR119HRH3 | |
| SCHEMBL20073407 | 0.79 | HPGD (0.47) | LRRK2MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL16982497 | 0.78 | KMT2A (0.53) | LRRK2MEN1KMT2AALDH1A1CYP2C19 | |
| SCHEMBL21650853 | 0.76 | FASN (0.45) | MEN1KMT2AALDH1A1CYP2C19CYP1A2 |
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-2658543-B1 | PYRUVATE KINASE M2 (PKM2) ACTIVATORS FOR USE IN THERAPY | AGIOS PHARMACEUTICALS INC (US) | 2019-02-20 | — | — | EP | disclosed |