Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 1/20 | 0.51 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.45 |
| ▸ | MMP3 | P08254 | 4/20 | 0.43 |
| ▸ | MMP2 | P08253 | 3/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MME | P08473 | 1/20 | 0.43 |
| ▸ | FDFT1 | P37268 | 2/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | BID | P55957 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | BAK1 | Q16611 | 1/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1861903 | 0.86 | GRIK1 (0.59) | GRIK1MMP3MMP2MMP1MMP9 | |
| SCHEMBL7923945 | 0.85 | MMP2 (0.57) | GRIK1HCAR2MMP3MMP2MMP1 | |
| SCHEMBL1860416 | 0.84 | GRIK1 (0.68) | GRIK1MMP3MMP2MMP1MMP9 | |
| SCHEMBL1866243 | 0.83 | GRIK1 (0.59) | GRIK1MMP3MMP2MMP1MMP9 | |
| SCHEMBL3468514 | 0.82 | SLC13A5 (0.53) | GRIK1MMP3MMP2MMEALDH1A1 | |
| SCHEMBL3467962 | 0.82 | PPARG (0.54) | GRIK1MME | |
| SCHEMBL3466957 | 0.82 | FFAR1 (0.51) | GRIK1MMP3MMP2MMP1MMP9 | |
| SCHEMBL7924101 | 0.81 | GRIK1 (0.54) | GRIK1MMP3MMP2MMP9MME | |
| SCHEMBL7922577 | 0.81 | PPARG (0.56) | GRIK1MMP3MMP2MMP9MME | |
| SCHEMBL1856639 | 0.81 | GRIK1 (0.72) | GRIK1MMP3MMP2MMP1MMP9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010070076-A1 | ALKANOIC ACID DERIVATIVES AND THEIR THERAPEUTIC USE AS HDAC INHIBITORS | CRYSTAX PHARMACEUTICALS, S.L. (ES) | 2010-06-24 | — | — | WO | disclosed |