Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.40 |
| ▸ | GDA | Q9Y2T3 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | KDM3B | Q7LBC6 | 1/20 | 0.34 |
| ▸ | TYMP | P19971 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | DPYD | Q12882 | 1/20 | 0.31 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | THPO | P40225 | 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 | |
|---|---|---|---|---|
| SCHEMBL1210894 | 0.76 | GAA (0.50) | PIM1PIM3ALDH1A1ATMGAA | |
| Uric Acid SCHEMBL822247 | 0.67 | GDA (0.76) | GDAALDH1A1GAAACHETYMP | |
| SCHEMBL3243045 | 0.66 | PIM3 (0.59) | PIM1PIM3ALDH1A1ATMMEN1 | |
| SCHEMBL1210851 | 0.65 | KDM3B (0.69) | PIM1PIM3ALDH1A1ATMGAA | |
| Uric Acid SCHEMBL8330954 | 0.64 | GDA (0.70) | GDAALDH1A1GAAACHETYMP | |
| SCHEMBL5045201 | 0.64 | DPYD (0.60) | GDAALDH1A1GAAACHEDPYD | |
| SCHEMBL9008314 | 0.64 | GDA (0.71) | GDAALDH1A1GAAACHETYMP | |
| SCHEMBL30853320 | 0.63 | BTK (0.45) | PIM1PIM3ALDH1A1ATMPDPK1 | |
| SCHEMBL6766607 | 0.63 | PDPK1 (0.51) | PIM1PIM3ALDH1A1ATMPDPK1 | |
| SCHEMBL16703602 | 0.63 | GAA (0.48) | ALDH1A1GAAKDM3BLMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1966215-A1 | CONDENSED HETEROCYCLIC COMPOUNDS USEFUL AS DPP-IV INHIBITORS | Novartis AG (CH) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007071738-A1 | CONDENSED HETEROCYCLIC COMPOUNDS USEFUL AS DPP-IV INHIBITORS | NOVARTIS AG (CH) | 2007-06-28 | — | — | WO | disclosed |