Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | PREP | P48147 | 4/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 3/20 | 0.43 |
| ▸ | CTSB | P07858 | 3/20 | 0.43 |
| ▸ | CTSK | P43235 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CTSS | P25774 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | KDM1A | O60341 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | RCOR1 | Q9UKL0 | 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 | |
|---|---|---|---|---|
| SCHEMBL5764459 | 0.82 | KDM1A (0.51) | NPC1RAB9APREPCTSLCTSB | |
| SCHEMBL6002580 | 0.82 | KDM1A (0.51) | NPC1RAB9APREPCTSLCTSB | |
| SCHEMBL5764315 | 0.80 | NPC1 (0.43) | NPC1RAB9APREPCASP3CTSL | |
| SCHEMBL541864 | 0.70 | ALDH1A1 (0.58) | NPC1RAB9ACASP3ALDH1A1GAA | |
| SCHEMBL2233522 | 0.68 | NPC1 (0.69) | NPC1RAB9ACASP3ALDH1A1MAOB | |
| SCHEMBL16193532 | 0.68 | NPC1 (0.69) | NPC1RAB9ACASP3MAOBPOLB | |
| SCHEMBL30522295 | 0.68 | NPC1 (0.69) | NPC1RAB9ACASP3MAOBPOLB | |
| SCHEMBL29950689 | 0.68 | NPC1 (0.64) | NPC1RAB9ACASP3ALDH1A1MAOB | |
| SCHEMBL4291027 | 0.68 | NPC1 (0.64) | NPC1RAB9ACASP3ALDH1A1MAOB | |
| SCHEMBL7982809 | 0.67 | NPC1 (0.50) | NPC1RAB9ACASP3KDM1A |
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-1656357-A1 | OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF | Merck & Co., Inc. (US) | 2006-05-17 | — | — | EP | disclosed |
| WO-2005005399-A1 | OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF | MERCK & CO., INC. (US) | 2005-01-20 | — | — | WO | disclosed |