Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 2/20 | 0.42 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.42 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.42 |
| ▸ | BTK | Q06187 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | GLS | O94925 | 1/20 | 0.40 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL28934278 | 1.00 | MEN1 (0.43) | MEN1ALDH1A1MAPTKMT2APIM1 | |
| SCHEMBL30101075 | 1.00 | MEN1 (0.43) | MEN1ALDH1A1MAPTKMT2APIM1 | |
| SCHEMBL24574884 | 0.99 | PIM1 (0.43) | MEN1ALDH1A1MAPTKMT2APIM1 | |
| SCHEMBL28934494 | 0.99 | PIM1 (0.43) | MEN1ALDH1A1MAPTKMT2APIM1 | |
| SCHEMBL31057329 | 0.97 | PIM1 (0.43) | MEN1ALDH1A1MAPTKMT2APIM1 | |
| SCHEMBL30157159 | 0.88 | BTK (0.45) | MEN1ALDH1A1MAPTKMT2APIM1 | |
| SCHEMBL24575643 | 0.88 | BTK (0.45) | MEN1ALDH1A1MAPTKMT2APIM1 | |
| SCHEMBL24575642 | 0.88 | BTK (0.45) | MEN1ALDH1A1MAPTKMT2APIM1 | |
| SCHEMBL24575377 | 0.88 | BTK (0.45) | MEN1ALDH1A1MAPTKMT2APIM1 | |
| SCHEMBL31057366 | 0.88 | BTK (0.45) | MEN1ALDH1A1MAPTKMT2APIM1 |
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-118302417-A | NLRP3 inhibitors | PTC医疗公司 | 2024-07-05 | — | — | CN | disclosed |
| CN-115433163-A | NLRP3 inflammasome inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2022-12-06 | — | — | CN | disclosed |