Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.42 |
| ▸ | CES1 | P23141 | 3/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL11303491 | 0.83 | HDAC4 (0.47) | CES2CES1GSK3BKMT2ATSHR | |
| SCHEMBL7636775 | 0.81 | HSD11B1 (0.46) | CES2CES1GSK3BTSHRALOX15 | |
| SCHEMBL4674968 | 0.79 | DRD2 (0.53) | CES2CES1GSK3BKMT2ATSHR | |
| SCHEMBL11988907 | 0.75 | POLB (0.51) | CES2CES1GSK3BGAATSHR | |
| SCHEMBL7325713 | 0.74 | DRD3 (0.38) | CES2CES1KMT2AMEN1TSHR | |
| SCHEMBL7327084 | 0.72 | MAPT (0.38) | TSHRCA1CA2ALDH1A1MAPT | |
| SCHEMBL7327175 | 0.71 | ALDH1A1 (0.36) | CES2CES1KMT2AMEN1ALDH1A1 | |
| SCHEMBL7327181 | 0.71 | ALDH1A1 (0.36) | CES2CES1KMT2AMEN1ALDH1A1 | |
| SCHEMBL7316370 | 0.71 | GAA (0.42) | GAATSHRALDH1A1HPGDCYP3A4 | |
| SCHEMBL18338013 | 0.71 | CES2 (0.50) | CES2CES1GSK3BKMT2AMEN1 |
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-0958287-B2 | SULFAMIDE-METALLOPROTEASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2008-04-09 | — | — | EP | disclosed |
| EP-0958287-B1 | SULFAMIDE-METALLOPROTEASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2002-09-11 | — | — | EP | disclosed |