Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | METAP2 | P50579 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ATG4B | Q9Y4P1 | 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 | |
|---|---|---|---|---|
| SCHEMBL15314640 | 0.86 | CNR1 (0.40) | NQO1MAPK14CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL12761525 | 0.85 | NQO1 (0.43) | NQO1MAPK14METAP2ALDH1A1HPGD | |
| SCHEMBL2051020 | 0.82 | ALDH1A1 (0.45) | METAP2ALDH1A1HPGDSMN1; SMN2NPC1 | |
| SCHEMBL12832932 | 0.81 | MAPK14 (0.43) | NQO1MAPK14METAP2ALDH1A1HPGD | |
| SCHEMBL15314588 | 0.80 | MEN1 (0.45) | MAPK14ALDH1A1HPGDSMN1; SMN2NPC1 | |
| SCHEMBL12761403 | 0.78 | MEN1 (0.46) | NQO1MAPK14METAP2ALDH1A1HPGD | |
| SCHEMBL15314595 | 0.77 | DHODH (0.42) | ALDH1A1HPGDSMN1; SMN2NPC1MAPT | |
| SCHEMBL15314662 | 0.76 | MEN1 (0.44) | MAPK14METAP2ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL15314653 | 0.75 | MAPT (0.47) | ALDH1A1HPGDSMN1; SMN2MAPTRECQL | |
| SCHEMBL15314597 | 0.75 | CYP11B1 (0.38) | NQO1CYP11B1CYP11B2ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1971595-B1 | CETP INHIBITORS | MERCK SHARP & DOHME (US) | 2013-10-16 | — | — | EP | disclosed |