Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.58 |
| ▸ | CNR1 | P21554 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.47 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | IL1RN | P18510 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28919025 | 1.00 | NR1H4 (0.58) | NR1H4CNR1TDP1AKR1C3AKR1C2 | |
| SCHEMBL28919042 | 0.90 | NR1H4 (0.54) | NR1H4CNR1TDP1AKR1C3AKR1C2 | |
| SCHEMBL30080374 | 0.90 | NR1H4 (0.54) | NR1H4CNR1TDP1AKR1C3AKR1C2 | |
| SCHEMBL28919039 | 0.84 | CNR1 (0.53) | NR1H4CNR1MAPTALDH1A1POLB | |
| SCHEMBL28919046 | 0.82 | P2RY12 (0.56) | NR1H4MAPTALDH1A1LMNATP53 | |
| SCHEMBL30080496 | 0.80 | NR1H4 (0.54) | NR1H4CNR1MAPTALDH1A1POLB | |
| SCHEMBL28919065 | 0.78 | POLB (0.61) | CNR1POLBATMMEN1KMT2A | |
| SCHEMBL28919023 | 0.78 | CNR1 (0.45) | NR1H4CNR1TDP1AKR1C3AKR1C2 | |
| SCHEMBL29784244 | 0.77 | KDM4E (0.66) | TDP1MAPTALDH1A1POLBGAA | |
| SCHEMBL1398597 | 0.77 | KDM4E (0.66) | TDP1MAPTALDH1A1POLBGAA |
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 2 patents. 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 |
| CN-115521272-A | Benzenesulfonyl piperazine compound and medical application thereof | 河北省人民医院 | 2022-12-27 | — | — | CN | disclosed |