Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 2/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.34 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | PTPRB | P23467 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
| ▸ | FNTA | P49354 | 1/20 | 0.31 |
| ▸ | FNTB | P49356 | 1/20 | 0.31 |
| ▸ | MME | P08473 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8675866 | 1.00 | CTSK (0.37) | CTSKGRIK1GRIK2SMN1; SMN2PTPRB | |
| SCHEMBL11865851 | 0.90 | CTSK (0.40) | CTSKGRIK1GRIK2SMN1; SMN2PTPRB | |
| SCHEMBL11865860 | 0.90 | CTSK (0.40) | CTSKGRIK1GRIK2SMN1; SMN2PTPRB | |
| SCHEMBL8158293 | 0.86 | GRIK1 (0.43) | CTSKGRIK1GRIK2SMN1; SMN2MEN1 | |
| SCHEMBL11861273 | 0.83 | GRIK1 (0.45) | CTSKGRIK1GRIK2FNTAFNTB | |
| SCHEMBL11861283 | 0.83 | GRIK1 (0.45) | CTSKGRIK1GRIK2FNTAFNTB | |
| SCHEMBL10870379 | 0.82 | ALDH1A1 (0.38) | CTSKGRIK1GRIK2MEN1KMT2A | |
| SCHEMBL10870370 | 0.82 | ALDH1A1 (0.38) | CTSKGRIK1GRIK2MEN1KMT2A | |
| SCHEMBL10870498 | 0.82 | ALDH1A1 (0.38) | CTSKGRIK1GRIK2MEN1KMT2A | |
| SCHEMBL11583962 | 0.81 | CTSK (0.35) | CTSKGRIK1GRIK2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5786501-A | Process for the preparation of pure alkyl alkylacetoacetates | LONZA AG (CH) | 1998-07-28 | — | — | US | disclosed |