Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | PI4KA | P42356 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31218404 | 1.00 | SMN1; SMN2 (0.56) | SMN1; SMN2MAPTRAB9ACYP3A4ALDH1A1 | |
| SCHEMBL28384381 | 0.78 | MAPT (0.40) | SMN1; SMN2MAPTRAB9AALDH1A1TP53 | |
| SCHEMBL10991202 | 0.72 | SMN1; SMN2 (1.00) | SMN1; SMN2MAPTRAB9ACYP3A4ALDH1A1 | |
| SCHEMBL20582165 | 0.72 | HSD17B10 (0.61) | SMN1; SMN2MAPTRAB9ACYP3A4ALDH1A1 | |
| SCHEMBL31218402 | 0.72 | HSD17B10 (0.61) | SMN1; SMN2MAPTRAB9ACYP3A4ALDH1A1 | |
| SCHEMBL30944287 | 0.72 | SMN1; SMN2 (1.00) | SMN1; SMN2MAPTRAB9ACYP3A4ALDH1A1 | |
| SCHEMBL13811094 | 0.71 | NPC1 (0.46) | SMN1; SMN2MAPTRAB9AALDH1A1TP53 | |
| SCHEMBL21138954 | 0.69 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTRAB9ACYP3A4ALDH1A1 | |
| SCHEMBL18791398 | 0.69 | SMN1; SMN2 (0.68) | SMN1; SMN2MAPTRAB9ACYP3A4ALDH1A1 | |
| SCHEMBL1707911 | 0.69 | SMN1; SMN2 (0.68) | SMN1; SMN2MAPTRAB9ACYP3A4ALDH1A1 |
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-111065626-A | Compounds for the treatment of huntington's chorea | PTC医疗公司 | 2020-04-24 | — | — | CN | disclosed |