Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.42 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.42 |
| ▸ | CACNA1I | Q9P0X4 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28521863 | 0.86 | AADAT (0.54) | AADATPOLBALDH1A1KMT2AMEN1 | |
| SCHEMBL28703394 | 0.86 | SMN1; SMN2 (0.41) | AADATSMN1; SMN2POLBALDH1A1CACNA1G | |
| SCHEMBL24507020 | 0.85 | KDM1A (0.52) | AADATSMN1; SMN2POLBALDH1A1CACNA1G | |
| SCHEMBL28518648 | 0.84 | ERCC5 (0.38) | AADATCACNA1GCACNA1HCACNA1I | |
| SCHEMBL28538329 | 0.83 | AADAT (0.38) | AADATSMN1; SMN2POLBALDH1A1KMT2A | |
| SCHEMBL29774650 | 0.82 | ALDH1A1 (0.43) | SMN1; SMN2POLBALDH1A1KMT2AMEN1 | |
| SCHEMBL28531542 | 0.82 | ALDH1A1 (0.43) | SMN1; SMN2POLBALDH1A1KMT2AMEN1 | |
| SCHEMBL28527545 | 0.79 | AADAT (0.53) | AADATSMN1; SMN2ALDH1A1KMT2AMEN1 | |
| SCHEMBL30915383 | 0.78 | MAPT (0.54) | AADATSMN1; SMN2POLBALDH1A1MAPT | |
| SCHEMBL28525980 | 0.78 | PARP1 (0.39) | POLBALDH1A1KMT2ARAB9AHDAC1 |
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-113891891-A | Modulators of AMPA receptor signaling | 戒毒及精神健康中心 | 2022-01-04 | — | — | CN | disclosed |
| CN-112390802-A | Pyrrolopyrazole derivative, preparation method and medical application thereof | 上海美迪西生物医药股份有限公司 | 2021-02-23 | — | — | CN | disclosed |