Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | CD38 | P28907 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL6693491 | 0.85 | NPC1 (0.42) | TDP1L3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL6685923 | 0.84 | RAB9A (0.38) | EPHX1 | |
| SCHEMBL6686989 | 0.82 | BTK (0.35) | CD38L3MBTL1ALDH1A1OPRL1 | |
| SCHEMBL6693494 | 0.82 | SLC6A9 (0.37) | EPHX1PARP10ALOX5 | |
| SCHEMBL6685915 | 0.82 | RAB9A (0.35) | PARP10ALDH1A1OPRL1MEN1KMT2A | |
| SCHEMBL6688042 | 0.82 | HTR7 (0.39) | TDP1PARP10ALDH1A1MEN1CYP3A4 | |
| SCHEMBL6685681 | 0.82 | EPHX2 (0.48) | EPHX1L3MBTL1ALDH1A1MEN1CYP3A4 | |
| SCHEMBL6686689 | 0.81 | ALDH1A1 (0.36) | EPHX1PARP10L3MBTL1ALDH1A1OPRL1 | |
| SCHEMBL6688679 | 0.80 | NPC1 (0.39) | TDP1EPHX1L3MBTL1ALDH1A1MEN1 | |
| SCHEMBL6690552 | 0.79 | TSHR (0.51) | EPHX1L3MBTL1CYP2D6KMT2A |
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-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |