Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.43 |
| ▸ | CTSB | P07858 | 2/20 | 0.43 |
| ▸ | CTSS | P25774 | 2/20 | 0.43 |
| ▸ | CTSK | P43235 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PPIB | P23284 | 1/20 | 0.38 |
| ▸ | PPID | Q08752 | 1/20 | 0.38 |
| ▸ | PPIG | Q13427 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10607269 | 0.78 | LMNA (0.31) | NPC1RAB9AMAPTNPSR1ALDH1A1 | |
| SCHEMBL20569698 | 0.75 | ALDH1A1 (0.46) | NPC1RAB9AMAPTNPSR1ALDH1A1 | |
| SCHEMBL20569697 | 0.75 | ALDH1A1 (0.46) | NPC1RAB9AMAPTNPSR1ALDH1A1 | |
| SCHEMBL10401106 | 0.74 | NPC1 (0.46) | CTSLCTSBCTSSCTSKNPC1 | |
| SCHEMBL9517517 | 0.74 | NPC1 (0.46) | CTSLCTSBCTSSCTSKNPC1 | |
| SCHEMBL9464386 | 0.74 | NPC1 (0.46) | CTSLCTSBCTSSCTSKNPC1 | |
| SCHEMBL10401417 | 0.72 | ALDH1A1 (0.46) | CTSLCTSBCTSSCTSKNPC1 | |
| SCHEMBL10401418 | 0.72 | ALDH1A1 (0.46) | CTSLCTSBCTSSCTSKNPC1 | |
| SCHEMBL9599471 | 0.70 | MCL1 (0.50) | NPC1ALDH1A1LMNAHPGDTSHR | |
| SCHEMBL10352692 | 0.70 | MCL1 (0.50) | NPC1ALDH1A1LMNAHPGDTSHR |
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-0206004-B1 | E-ISOMERS OF N-ALPHA-(2-CYANO-2-ALKOXYIMINOACETYL)-AMINO-ACID DERIVATIVES AND PEPTIDES | BAYER AG (DE) | 1993-04-28 | — | — | EP | disclosed |
| EP-0206004-A1 | E-isomers of N-alpha-(2-cyano-2-alkoxyiminoacetyl)-amino-acid derivatives and peptides | BAYER AG (DE) | 1986-12-30 | — | — | EP | disclosed |