Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5682857 | 0.85 | KDM4E (0.45) | HSD17B10KDM4EALDH1A1MAPTPOLB | |
| SCHEMBL5682959 | 0.79 | KDM4E (0.47) | HSD17B10KDM4EALDH1A1MAPTPOLB | |
| SCHEMBL8887655 | 0.79 | KDM4E (0.42) | HSD17B10KDM4EALDH1A1MAPTPOLB | |
| SCHEMBL7596917 | 0.78 | KDM4E (0.46) | HSD17B10KDM4EALDH1A1MAPTPOLB | |
| SCHEMBL21722984 | 0.78 | KDM4E (0.54) | HSD17B10KDM4EALDH1A1MAPTPOLB | |
| SCHEMBL5683319 | 0.78 | GLA (0.41) | KDM4EGLAALDH1A1MAPTACHE | |
| SCHEMBL294836 | 0.74 | CYP1A2 (0.50) | KDM4EALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL7593462 | 0.73 | KMT2A (0.50) | HSD17B10KDM4EALDH1A1MAPTPOLB | |
| SCHEMBL27483066 | 0.73 | GLA (0.47) | HSD17B10KDM4EGLAALDH1A1MAPT | |
| SCHEMBL7598674 | 0.70 | KMT2A (0.47) | HSD17B10KDM4EALDH1A1MAPTPOLB |
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-1645556-A1 | Arylpiperazine-benzoylamide derivatives useful as pharmaceutical agents | Boehringer Ingelheim International GmbH (DE) | 2006-04-12 | — | — | EP | disclosed |