Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL9250109 | 0.81 | SLC29A1 (0.52) | NPC1RAB9AALDH1A1SLC29A1ACHE | |
| SCHEMBL7806812 | 0.81 | RAB9A (0.74) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL9031073 | 0.79 | NPC1 (0.56) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL7813743 | 0.77 | RAB9A (0.56) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| Trifluoroacetic Acid SCHEMBL211386 | 0.76 | SLC2A1 (0.57) | ALDH1A1SLC2A1MAPTPOLBDRD4 | |
| SCHEMBL7289700 | 0.76 | KDM4E (0.62) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL7289611 | 0.75 | CHRM5 (0.50) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL7525895 | 0.75 | KDM4E (0.61) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL7801883 | 0.75 | NPC1 (0.53) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL8556919 | 0.74 | NPC1 (0.56) | NPC1RAB9AALDH1A1SLC29A1ACHE |
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 |