Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.37 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6664500 | 0.89 | NR1H2 (0.41) | NR4A2ALDH1A1MAPTPOLBKDM4E | |
| SCHEMBL6662371 | 0.89 | MAOB (0.38) | PARP10MAOBNR4A2 | |
| SCHEMBL6663534 | 0.88 | NNMT (0.41) | PARP10MAOBNR4A2CCKBR | |
| SCHEMBL6664648 | 0.84 | ALDH1A1 (0.49) | RXFP1ALDH1A1MAPTMAPK1POLB | |
| SCHEMBL6678968 | 0.79 | NR1H2 (0.49) | L3MBTL1ALDH1A1POLBKDM4ECCKBR | |
| SCHEMBL6665597 | 0.78 | ROCK2 (0.41) | ALDH1A1MAPT | |
| SCHEMBL6680821 | 0.77 | ALDH1A1 (0.41) | NR4A2RAB9AALDH1A1MAPTKDM4E | |
| SCHEMBL6666774 | 0.77 | MAPT (0.47) | PARP10MAOBNR4A2TP53PKM | |
| SCHEMBL6680077 | 0.76 | NR1H2 (0.40) | MAOBALDH1A1POLBKDM4ECCKAR | |
| SCHEMBL6669268 | 0.75 | ROCK2 (0.38) | L3MBTL1 |
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-2004014388-A1 | 6,6-FUSED HETEROARYL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |