Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.53 |
| ▸ | MAPT | P10636 | 6/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8555004 | 0.85 | ALDH1A1 (0.57) | ALDH1A1MAPTLMNANPC1RAB9A | |
| SCHEMBL9255657 | 0.83 | SLC29A1 (0.41) | ALDH1A1MAPTLMNAMEN1KMT2A | |
| SCHEMBL29106529 | 0.80 | ALDH1A1 (0.56) | ALDH1A1MAPTLMNAGAAGLA | |
| SCHEMBL8558093 | 0.78 | NPC1 (0.51) | ALDH1A1MAPTLMNANPC1RAB9A | |
| SCHEMBL12005556 | 0.78 | ALDH1A1 (0.64) | ALDH1A1MAPTLMNAMEN1KMT2A | |
| SCHEMBL7801883 | 0.78 | NPC1 (0.53) | ALDH1A1MAPTLMNANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL7519848 | 0.77 | NPC1 (0.52) | ALDH1A1MAPTLMNANPC1RAB9A | |
| SCHEMBL13861942 | 0.74 | ALDH1A1 (0.58) | ALDH1A1MAPTLMNAKDM4EMEN1 | |
| SCHEMBL31639389 | 0.74 | ALDH1A1 (0.70) | ALDH1A1MAPTLMNAGAAMEN1 | |
| SCHEMBL18072532 | 0.74 | CHRM3 (0.53) | ALDH1A1MAPTLMNAKDM4EMEN1 |
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-0582164-B1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | BRISTOL MYERS SQUIBB CO (US) | 1998-12-23 | — | — | EP | 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 |