Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.33 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL878148 | 0.84 | ALDH1A1 (0.38) | ALDH1A1PTGS2KDM4ERCE1 | |
| SCHEMBL5995232 | 0.73 | MAPT (0.43) | MAPTPTGS2 | |
| SCHEMBL2964988 | 0.72 | GABRA1 (0.45) | ALDH1A1MAPTGABRA1GABRB2CLCN2 | |
| SCHEMBL10522348 | 0.70 | GABRA1 (0.46) | ALDH1A1MAPTGABRA1GABRB2CLCN2 | |
| SCHEMBL27942173 | 0.70 | ALDH1A1 (0.39) | ALDH1A1PTGS2KEAP1 | |
| SCHEMBL10218791 | 0.69 | GABRA1 (0.45) | ALDH1A1MAPTGABRA1GABRB2CLCN2 | |
| SCHEMBL10448955 | 0.69 | GABRA1 (0.45) | ALDH1A1MAPTGABRA1GABRB2CLCN2 | |
| SCHEMBL20592727 | 0.67 | POLQ (0.44) | ALDH1A1MAPTGABRA1GABRB2KDM4E | |
| SCHEMBL7192004 | 0.67 | GABRA1 (0.43) | ALDH1A1MAPTGABRA1GABRB2KDM4E | |
| SCHEMBL9556057 | 0.67 | GABRA1 (0.39) | ALDH1A1MAPTGABRA1GABRB2CLCN2 |
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-2619179-A1 | MATRIX METALLOPROTEINASE INHIBITORS | Ranbaxy Laboratories Limited (IN) | 2013-07-31 | — | — | EP | claimed |
| WO-2012038944-A1 | MATRIX METALLOPROTEINASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2012-03-29 | — | — | WO | claimed |