Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 1/20 | 0.34 |
| ▸ | GCG | P01275 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6989326 | 0.92 | RAB9A (0.38) | NPC1RAB9ALMNAMEN1KMT2A | |
| SCHEMBL6986218 | 0.89 | TRPV1 (0.40) | MCHR1EPHX2DHODH | |
| SCHEMBL6985875 | 0.89 | LMNA (0.40) | NPC1RAB9ALMNAMCHR1MEN1 | |
| SCHEMBL6985259 | 0.87 | HDAC1 (0.40) | NAMPTNPC1RAB9AKMT2A | |
| SCHEMBL6987802 | 0.86 | KMT2A (0.41) | BACE1NPC1RAB9ALMNAEPHX2 | |
| SCHEMBL6987790 | 0.86 | TAS1R3 (0.38) | NAMPTNPC1RAB9A | |
| SCHEMBL6986287 | 0.84 | CHRM4 (0.39) | DPP4NPC1RAB9A | |
| SCHEMBL6990430 | 0.81 | GCGR (0.41) | GCGR | |
| SCHEMBL6996553 | 0.80 | DPP4 (0.37) | NAMPTCD274DPP4MCHR1EPHX2 | |
| SCHEMBL6753439 | 0.76 | CTSK (0.48) | — |
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-1362042-A1 | CYCLIC 2-CARBONYLAMINOKETONES AS INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | Amura Therapeutics Limited (GB) | 2003-11-19 | — | — | EP | disclosed |
| WO-2002057249-A1 | CYCLIC 2-CARBONYLAMINOKETONES AS INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | AMURA THERAPEUTICS LIMITED (GB) | 2002-07-25 | — | — | WO | disclosed |