Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | FAAH | O00519 | 8/20 | 0.48 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 4/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL1121793 | 0.99 | HDAC6 (0.49) | HDAC6FAAHPIK3CAESR1ESR2 | |
| Hydrochloric Acid SCHEMBL1121658 | 0.99 | HDAC6 (0.49) | HDAC6FAAHPIK3CAESR1ESR2 | |
| SCHEMBL14867048 | 0.90 | HDAC6 (0.55) | HDAC6FAAHPIK3CAESR1ESR2 | |
| SCHEMBL13543026 | 0.84 | SSTR5 (0.48) | HDAC6FAAH | |
| SCHEMBL13543034 | 0.84 | HDAC6 (0.47) | HDAC6FAAHPIK3CA | |
| Hydrochloric Acid SCHEMBL4947954 | 0.83 | HDAC6 (0.46) | HDAC6FAAHPIK3CA | |
| Hydrochloric Acid SCHEMBL27695367 | 0.83 | HDAC6 (0.46) | HDAC6FAAHPIK3CA | |
| Bromide SCHEMBL3570502 | 0.83 | SSTR5 (0.48) | HDAC6FAAH | |
| SCHEMBL1121922 | 0.82 | FAAH (0.52) | HDAC6FAAHPIK3CA | |
| SCHEMBL13543033 | 0.81 | SSTR5 (0.52) | HDAC6FAAH |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101253171-B | Benzooxazole, oxazolopyridine, benzothiazole and thiazolopyridine derivatives | HOFFMANN LA ROCHE | 2011-06-15 | — | — | CN | disclosed |
| CN-101253171-A | Benzooxazole, oxazolopyridine, benzothiazole and thiazolopyridine derivatives | HOFFMANN LA ROCHE (CH) | 2008-08-27 | — | — | CN | disclosed |
| EP-1924579-A2 | BENZOOXAZOLE, OXAZOLOPYRIDINE, BENZOTHIAZOLE AND THIAZOLOPYRIDINE DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 2008-05-28 | — | — | EP | disclosed |
| WO-2007025897-A2 | BENZOOXAZOLE, OXAZOLOPYRIDINE, BENZOTHIAZOLE AND THIAZOLOPYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2007-03-08 | — | — | WO | disclosed |