Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.53 |
| ▸ | MMP3 | P08254 | 5/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3469955 | 0.92 | SLC13A5 (0.46) | PTPN1MMP3MMP2MCL1AKR1B1 | |
| SCHEMBL3467371 | 0.86 | MMP3 (0.58) | MMP3MMP2ALDH1A1KMT2A | |
| SCHEMBL1858161 | 0.85 | KMT2A (0.52) | TDP1MCL1AKR1B1KMT2AMTNR1A | |
| SCHEMBL1862472 | 0.84 | KMT2A (0.47) | MMP3TDP1MMP2MCL1AKR1B1 | |
| SCHEMBL7929539 | 0.83 | MMP2 (0.48) | MMP3MMP2AKR1B1MAPTKMT2A | |
| SCHEMBL7924568 | 0.83 | MMP12 (0.48) | MMP3MMP2HPGDMCL1AKR1B1 | |
| SCHEMBL3476425 | 0.83 | PTPN1 (0.46) | PTPN1HPGDMCL1AKR1B1MTNR1A | |
| SCHEMBL1856418 | 0.82 | ALDH1A1 (0.56) | MMP3MMP2ALDH1A1MEN1KMT2A | |
| SCHEMBL1859538 | 0.81 | MMP12 (0.47) | MMP3MMP2ALDH1A1 | |
| SCHEMBL10643738 | 0.81 | LDHA (0.54) | MMP3MMP2ALDH1A1KMT2A |
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 |