Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | MMP1 | P03956 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL2220322 | 0.92 | ALDH1A1 (0.40) | SCN9ASCN5AHDAC1ALDH1A1KMT2A | |
| SCHEMBL1503299 | 0.92 | SCN9A (0.36) | ADAMTS4MMP2MMP13MMP14ADAMTS5 | |
| SCHEMBL1503267 | 0.91 | HDAC1 (0.41) | SCN9ASCN5AHDAC1HDAC3HDAC2 | |
| SCHEMBL30954808 | 0.91 | HDAC1 (0.41) | SCN9ASCN5AHDAC1HDAC3HDAC2 | |
| SCHEMBL1503187 | 0.86 | ALDH1A1 (0.41) | ALDH1A1KMT2AMEN1MAPTGAA | |
| SCHEMBL22738223 | 0.85 | SCN9A (0.41) | SCN9ASCN5AMAPTMAOB | |
| SCHEMBL1503250 | 0.85 | MMP1 (0.39) | ADAMTS4MMP2MMP13MMP14ADAMTS5 | |
| SCHEMBL30954811 | 0.85 | MMP1 (0.39) | ADAMTS4MMP2MMP13MMP14ADAMTS5 | |
| SCHEMBL22719903 | 0.83 | GRIN1 (0.43) | SCN9ASCN5AALDH1A1MAPTCYP2C19 | |
| SCHEMBL22738285 | 0.82 | MEN1 (0.40) | SCN9ASCN5AHDAC3KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2300433-A1 | HIV INTEGRASE INHIBITORS FROM PYRIDOXINE | Ambrilia Biopharma Inc. (CA) | 2011-03-30 | — | — | EP | disclosed |
| WO-2009146555-A1 | HIV INTEGRASE INHIBITORS FROM PYRIDOXINE | AMBRILIA BIOPHARMA INC. (CA) | 2009-12-10 | — | — | WO | disclosed |