Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7801883 | 0.83 | NPC1 (0.53) | NPC1RAB9AALDH1A1MAPTGAA | |
| SCHEMBL8556919 | 0.83 | NPC1 (0.56) | NPC1RAB9AALDH1A1MAPTGAA | |
| Hydrochloric Acid SCHEMBL7519848 | 0.82 | NPC1 (0.52) | NPC1RAB9AALDH1A1MAPTGAA | |
| SCHEMBL8553179 | 0.78 | ALDH1A1 (0.53) | NPC1RAB9AALDH1A1MAPTGAA | |
| SCHEMBL9825041 | 0.73 | ALDH1A1 (0.48) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL8554274 | 0.73 | KDR (0.45) | NPC1RAB9AALDH1A1MAPTGAA | |
| SCHEMBL8554495 | 0.72 | ALDH1A1 (0.47) | RAB9AALDH1A1MAPTHTTSMN1; SMN2 | |
| SCHEMBL6819578 | 0.71 | ALDH1A1 (0.69) | RAB9AALDH1A1MAPTGAALMNA | |
| SCHEMBL6819275 | 0.70 | ALDH1A1 (0.69) | RAB9AALDH1A1MAPTGAALMNA | |
| SCHEMBL6815807 | 0.70 | ALDH1A1 (0.69) | RAB9AALDH1A1MAPTGAALMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0582164-B1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | BRISTOL MYERS SQUIBB CO (US) | 1998-12-23 | — | — | EP | disclosed |
| US-5382584-A | Antiischemic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-01-17 | — | — | US | disclosed |
| EP-0582164-A1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | Bristol-Myers Squibb Company (US) | 1994-02-09 | — | — | EP | disclosed |