Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.42 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.42 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2817033 | 0.83 | ALDH1A1 (0.50) | ALDH1A1POLBMAPK1MAPTTP53 | |
| SCHEMBL13594836 | 0.80 | ALDH1A1 (0.43) | ALDH1A1POLBMAPK1MAPTTP53 | |
| SCHEMBL13016868 | 0.78 | GRIN2D (0.47) | ALDH1A1MAPTSMN1; SMN2GRIN2DGRIN3B | |
| SCHEMBL396378 | 0.78 | ALDH1A1 (0.46) | ALDH1A1POLBMAPK1MAPTTP53 | |
| SCHEMBL11176915 | 0.77 | GRIN2D (0.46) | ALDH1A1POLBMAPK1MAPTSMN1; SMN2 | |
| SCHEMBL7607688 | 0.77 | MAPK1 (0.52) | ALDH1A1POLBMAPK1MAPTGAA | |
| SCHEMBL111213 | 0.76 | ALDH1A1 (0.50) | ALDH1A1POLBMAPK1MAPTGRIN2D | |
| SCHEMBL428785 | 0.76 | ALDH1A1 (0.49) | ALDH1A1POLBMAPK1MAPTHSD11B1 | |
| SCHEMBL9190923 | 0.76 | KMT2A (0.42) | ALDH1A1POLBMAPK1MAPTTP53 | |
| SCHEMBL9265750 | 0.76 | MAPT (0.43) | ALDH1A1POLBMAPK1MAPTTP53 |
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-1326606-A2 | EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS | PFIZER PHARMACEUTICALS INC. (JP) | 2003-07-16 | — | — | EP | disclosed |
| WO-2002032422-A2 | EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS | PFIZER PHARMACEUTICALS INC. (JP) | 2002-04-25 | — | — | WO | disclosed |