Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | MAOB | P27338 | 4/20 | 0.53 |
| ▸ | NR4A2 | P43354 | 3/20 | 0.52 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.49 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.48 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.47 |
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PLA2G4B | P0C869 | 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 | |
|---|---|---|---|---|
| SCHEMBL27395760 | 0.87 | MEN1 (0.57) | MEN1KMT2AMAOBNR4A2PARP10 | |
| SCHEMBL8557631 | 0.86 | MEN1 (0.56) | MEN1KMT2AMAOBNR4A2PARP10 | |
| SCHEMBL7110511 | 0.84 | MAOB (0.67) | MEN1KMT2AMAOBNR4A2PARP10 | |
| SCHEMBL417403 | 0.83 | KMT2A (0.59) | MEN1KMT2AMAOBNR4A2PARP10 | |
| SCHEMBL28527489 | 0.82 | SRD5A2 (0.59) | MEN1KMT2AMAOBNR4A2PARP10 | |
| SCHEMBL5221387 | 0.82 | LMNA (0.62) | MEN1KMT2AMAOBNR4A2PARP10 | |
| SCHEMBL1800966 | 0.81 | NR4A2 (0.74) | MEN1KMT2AMAOBNR4A2PTPN1 | |
| Hydrochloric Acid SCHEMBL5221379 | 0.81 | LMNA (0.60) | MEN1KMT2AMAOBNR4A2PARP10 | |
| SCHEMBL9170360 | 0.79 | MAOB (0.72) | MEN1KMT2AMAOBPARP10SMN1; SMN2 | |
| SCHEMBL11026165 | 0.79 | MEN1 (0.54) | MEN1KMT2AMAOBNR4A2PARP10 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110087729-B | Bifunctional compound with quaternary ammonium salt structure | 北京硕佰医药科技有限责任公司 | 2022-04-05 | — | — | CN | disclosed |
| EP-3556435-B1 | CLASS OF BIFUNCTIONAL COMPOUNDS WITH QUATERNARY AMMONIUM SALT STRUCTURE | BEIJING SHOWBY PHARMACEUTICAL CO LTD (CN) | 2020-10-28 | — | — | EP | disclosed |
| EP-3556435-A1 | CLASS OF BIFUNCTIONAL COMPOUNDS WITH QUATERNARY AMMONIUM SALT STRUCTURE | Beijing Showby Pharmaceutical Co., Ltd. (CN) | 2019-10-23 | — | — | EP | disclosed |
| CN-110087729-A | One kind has the dual-function compound of quaternary ammonium salt structure | 北京硕佰医药科技有限责任公司 | 2019-08-02 | — | — | CN | disclosed |