Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.33 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4402971 | 0.81 | ADORA2A (0.41) | ADORA2AADORA2BL3MBTL1LMNAALDH1A1 | |
| SCHEMBL30809494 | 0.81 | ADORA2A (0.41) | ADORA2AADORA2BLMNAALDH1A1KDM4E | |
| SCHEMBL1145053 | 0.81 | ADORA2A (0.41) | ADORA2AADORA2BLMNAALDH1A1KDM4E | |
| SCHEMBL4140051 | 0.77 | ADORA2A (0.38) | ADORA2AADORA2BLMNA | |
| SCHEMBL4403122 | 0.76 | MAPK1 (0.43) | LMNAKDM4EMAPTATMPAK1 | |
| SCHEMBL1144961 | 0.73 | MEN1 (0.39) | ADORA2AADORA2BLMNAALDH1A1KDM4E | |
| SCHEMBL4403674 | 0.73 | ACACB (0.43) | — | |
| SCHEMBL9720573 | 0.70 | PPARA (0.46) | L3MBTL1PPARAALDH1A1KDM4EHPGD | |
| SCHEMBL13675149 | 0.70 | ADORA2A (0.43) | ADORA2AADORA2BLMNAALDH1A1KDM4E | |
| SCHEMBL1144623 | 0.70 | CA12 (0.49) | ALDH1A1KDM4EHPGDCYP2C19PDE4D |
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-2012056372-A1 | N1/N2-LACTAM ACETYL-CoA CARBOXYLASE INHIBITORS | PFIZER INC. (US) | 2012-05-03 | — | — | WO | disclosed |