Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 3/20 | 0.52 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.52 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29043239 | 0.88 | PKM (0.51) | PIK3CDPIK3CBPIK3CARAB9ALMNA | |
| SCHEMBL29043232 | 0.79 | NR1H4 (0.46) | NR1H4CNR1POLBRAB9AATM | |
| SCHEMBL28919033 | 0.77 | HDAC3 (0.58) | NR1H4CNR1ATMLMNASMN1; SMN2 | |
| SCHEMBL28919038 | 0.77 | CNR1 (0.47) | NR1H4CNR1POLBATMALDH1A1 | |
| SCHEMBL13787617 | 0.73 | PIK3CD (0.74) | PIK3CDPIK3CBPIK3CARAB9AALDH1A1 | |
| SCHEMBL16404868 | 0.72 | PIK3CD (0.72) | PIK3CDPIK3CBPIK3CARAB9AALDH1A1 | |
| SCHEMBL28919029 | 0.71 | HDAC3 (0.54) | CNR1ATMLMNAMAPTSMN1; SMN2 | |
| Pivalate SCHEMBL28919013 | 0.70 | CNR1 (0.60) | NR1H4CNR1POLBATMMAPK1 | |
| SCHEMBL28919039 | 0.70 | CNR1 (0.53) | NR1H4CNR1POLBATMALDH1A1 | |
| SCHEMBL30080496 | 0.69 | NR1H4 (0.54) | NR1H4CNR1POLBATMALDH1A1 |
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-115521272-B | Benzenesulfonyl piperazine compound and medical application thereof | 河北省人民医院 | 2023-07-21 | — | — | CN | disclosed |