Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 6/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Boric Acid SCHEMBL29234413 | 0.95 | ALDH1A1 (0.43) | ALDH1A1MAPK1NPC1RAB9AMAOB | |
| SCHEMBL2733818 | 0.82 | ALDH1A1 (0.51) | ALDH1A1MAPK1NPC1RAB9AMAOB | |
| Ammonia Solution, Strong SCHEMBL19469522 | 0.76 | PPARA (0.49) | ALDH1A1MAPK1MAOBCYP3A4LMNA | |
| SCHEMBL28564927 | 0.75 | LMNA (0.51) | ALDH1A1MAPK1RAB9ACYP3A4LMNA | |
| SCHEMBL746722 | 0.72 | ALDH1A1 (0.56) | ALDH1A1MAPK1NPC1RAB9AMAOB | |
| SCHEMBL2193764 | 0.72 | CYP3A4 (0.39) | ALDH1A1MAPK1NPC1RAB9ACYP3A4 | |
| SCHEMBL6165864 | 0.72 | ALDH1A1 (0.78) | ALDH1A1MAPK1NPC1RAB9AMAOB | |
| SCHEMBL1855445 | 0.72 | LMNA (0.62) | ALDH1A1MAPK1NPC1RAB9ACYP3A4 | |
| SCHEMBL14075677 | 0.72 | MAOB (0.49) | ALDH1A1MAPK1NPC1RAB9AMAOB | |
| SCHEMBL12208553 | 0.71 | MAOB (0.57) | ALDH1A1MAPK1NPC1RAB9AMAOB |
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 |
|---|---|---|---|---|---|---|---|
| CN-101981037-B | Pyrazolopyrimidine PI3K inhibitor compounds and methods of use | GENENTECH INC | 2013-09-04 | — | — | CN | disclosed |