Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | GLS | O94925 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3718010 | 0.83 | ATM (0.60) | LMNANPC1RAB9AATM | |
| SCHEMBL1794493 | 0.82 | NPC1 (0.52) | HSP90AA1NPC1RAB9ASIGMAR1CNR1 | |
| SCHEMBL6477205 | 0.81 | HSP90AA1 (0.55) | LMNAHSP90AA1NPC1RAB9ACNR1 | |
| SCHEMBL3832809 | 0.79 | GLS (0.46) | EGFRERBB2GLSSIGMAR1FFAR1 | |
| SCHEMBL7796993 | 0.79 | ALDH1A1 (0.53) | LMNANPC1RAB9ASIGMAR1 | |
| SCHEMBL901955 | 0.79 | NPC1 (0.63) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL1448505 | 0.78 | EGFR (0.53) | EGFRERBB2GLSNPC1CA12 | |
| SCHEMBL5950139 | 0.76 | EGFR (0.49) | EGFRERBB2GLSNPC1 | |
| SCHEMBL3008052 | 0.75 | EGFR (0.48) | EGFRERBB2GLSNPC1RAB9A | |
| SCHEMBL1750050 | 0.75 | CYP1A2 (0.58) | EGFRERBB2LMNANPC1RAB9A |
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-1159260-A1 | NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2001-12-05 | — | — | EP | disclosed |
| WO-2000055124-A2 | NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2000-09-21 | — | — | WO | disclosed |