Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.35 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24794750 | 1.00 | MAPT (0.43) | MAPTLMNAALDH1A1ESR2SIRT6 | |
| SCHEMBL23122347 | 0.84 | MAPT (0.43) | MAPTLMNAALDH1A1SIRT6PKM | |
| SCHEMBL24793986 | 0.84 | NAMPT (0.51) | MAPTLMNAALDH1A1ESR2NAMPT | |
| SCHEMBL29709692 | 0.84 | NAMPT (0.51) | MAPTLMNAALDH1A1ESR2NAMPT | |
| SCHEMBL29197658 | 0.80 | ESR2 (0.55) | MAPTLMNAALDH1A1ESR2NR1H2 | |
| SCHEMBL3986657 | 0.78 | ESR2 (0.45) | ESR2NR1H2NAMPTMAPK1PTPN2 | |
| SCHEMBL17962178 | 0.78 | NR1H2 (0.41) | MAPTLMNAALDH1A1ESR2NR1H2 | |
| SCHEMBL24794715 | 0.77 | NAMPT (0.51) | MAPTLMNAALDH1A1ESR2NAMPT | |
| SCHEMBL31324785 | 0.77 | QDPR (0.41) | MAPTLMNAALDH1A1ESR2SIRT6 | |
| SCHEMBL29267658 | 0.77 | QDPR (0.41) | MAPTLMNAALDH1A1ESR2SIRT6 |
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-114761386-A | Substituted N-heterocyclic carboxamides as acid ceramidase inhibitors and their use as pharmaceuticals | 比亚尔R&D投资股份公司 | 2022-07-15 | — | — | CN | disclosed |