Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL5696554 | 0.83 | HPGD (0.44) | L3MBTL1PTGES2POLBCA12CA1 | |
| SCHEMBL27690268 | 0.78 | NFE2L2 (0.50) | L3MBTL1CA12CA1CA2CA9 | |
| SCHEMBL14686399 | 0.78 | CA12 (0.36) | L3MBTL1PTGES2CA12CA1CA2 | |
| SCHEMBL14686293 | 0.78 | PTGS1 (0.34) | CA12CA1CA2CA9KDM4E | |
| SCHEMBL27704261 | 0.76 | PTGES2 (0.45) | L3MBTL1PTGES2SLC22A12GAAALDH1A1 | |
| SCHEMBL29538287 | 0.76 | ALDH1A1 (0.55) | L3MBTL1PTGES2POLBCA12CA1 | |
| SCHEMBL908602 | 0.76 | ALDH1A1 (0.55) | L3MBTL1PTGES2POLBCA12CA1 | |
| SCHEMBL13012150 | 0.74 | PTGES2 (0.53) | L3MBTL1PTGES2POLBCA12CA1 | |
| SCHEMBL14686369 | 0.74 | TRPV4 (0.43) | DRD1LMNAMAPTSMN1; SMN2NPC1 | |
| SCHEMBL14686396 | 0.74 | TRPV4 (0.54) | DRD1SLC22A12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1865940-B1 | ALPHA KETOAMIDE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS | VIROBAY INC (US) | 2013-02-13 | — | — | EP | claimed |