Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | LOX | P28300 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9696700 | 0.80 | ALDH1A1 (0.42) | ALDH1A1NPC1RAB9ATP53LOX | |
| SCHEMBL9695693 | 0.80 | ALDH1A1 (0.42) | ALDH1A1NPC1RAB9ATP53LOX | |
| SCHEMBL9695785 | 0.76 | PIM3 (0.48) | ALDH1A1NPC1RAB9ATP53LOX | |
| SCHEMBL25951466 | 0.76 | ALDH1A1 (0.42) | ALDH1A1NPC1RAB9ATP53LOX | |
| SCHEMBL9696021 | 0.74 | NPC1 (0.40) | ALDH1A1NPC1RAB9ATP53LOX | |
| SCHEMBL9696024 | 0.73 | ALDH1A1 (0.48) | ALDH1A1NPC1RAB9ATP53LOX | |
| SCHEMBL9696717 | 0.73 | KDM4E (0.45) | ALDH1A1NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL9696233 | 0.71 | ADORA2A (0.62) | ADORA2AADORA1MEN1KMT2A | |
| SCHEMBL9694504 | 0.71 | MEN1 (0.63) | ALDH1A1SMN1; SMN2KDM4ECYP1A2CYP2C19 | |
| SCHEMBL26719801 | 0.70 | HSP90AA1 (0.39) | ADORA2AADORA1HSP90AA1HSP90AB1 |
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-1992007468-A1 | HERBICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-05-14 | — | — | WO | disclosed |