Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.55 |
| ▸ | NPC1 | O15118 | 6/20 | 0.55 |
| ▸ | RAB9A | P51151 | 6/20 | 0.55 |
| ▸ | TP53 | P04637 | 3/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.48 |
| ▸ | RELA | Q04206 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | GRM2 | Q14416 | 4/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9326924 | 0.91 | SMN1; SMN2 (0.57) | SMN1; SMN2NPC1RAB9ATP53PKM | |
| SCHEMBL9325558 | 0.88 | SMN1; SMN2 (0.55) | SMN1; SMN2NPC1RAB9ATP53PKM | |
| SCHEMBL14268238 | 0.88 | GRM2 (0.47) | SMN1; SMN2NPC1RAB9ATP53PKM | |
| SCHEMBL15060602 | 0.88 | GRM2 (0.47) | SMN1; SMN2NPC1RAB9ATP53PKM | |
| SCHEMBL9325528 | 0.87 | SMN1; SMN2 (0.60) | SMN1; SMN2NPC1RAB9ATP53PKM | |
| SCHEMBL9325610 | 0.85 | RAB9A (0.59) | SMN1; SMN2NPC1RAB9ATP53PKM | |
| SCHEMBL9328543 | 0.85 | RAB9A (0.59) | SMN1; SMN2NPC1RAB9ATP53PKM | |
| SCHEMBL9327607 | 0.85 | NPC1 (0.51) | SMN1; SMN2NPC1RAB9ATP53PKM | |
| SCHEMBL9328544 | 0.84 | RAB9A (0.54) | SMN1; SMN2NPC1RAB9ATP53PKM | |
| SCHEMBL9328291 | 0.84 | RAB9A (0.54) | SMN1; SMN2NPC1RAB9ATP53PKM |
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-2012069856-A1 | ANTIMALARIAL COMPOUNDS | LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) | 2012-05-31 | — | — | WO | disclosed |