Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 7/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.34 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA9 | Q16790 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14686399 | 0.88 | CA12 (0.36) | PTGS1PTGS2CA12CA2CA9 | |
| SCHEMBL14686367 | 0.78 | L3MBTL1 (0.46) | CA12CA2CA9CA1GAA | |
| SCHEMBL2377439 | 0.73 | LMNA (0.34) | PTGS1PTGS2CA12CA2CA9 | |
| SCHEMBL14686369 | 0.70 | TRPV4 (0.43) | TRPV4NFE2L2 | |
| SCHEMBL2378342 | 0.70 | CA12 (0.37) | PTGS1PTGS2CA12CA2CA9 | |
| SCHEMBL14686396 | 0.70 | TRPV4 (0.54) | TRPV4NFE2L2 | |
| SCHEMBL16114581 | 0.69 | DRD1 (0.38) | CA12CA2CA9GAACA14 | |
| SCHEMBL14943109 | 0.69 | CYP2E1 (0.38) | CA12CA2CA9CA1GAA | |
| SCHEMBL28038210 | 0.68 | SLC22A12 (0.41) | PTGS1PTGS2CYP17A1 | |
| SCHEMBL31543981 | 0.68 | KDM4E (0.37) | GAATRPV4KDM4E |
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 |