Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.59 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.59 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2212694 | 0.76 | CYP19A1 (0.67) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL855317 | 0.74 | ADORA3 (0.59) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL1135524 | 0.74 | ADORA2A (1.00) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL17336643 | 0.74 | ADORA3 (0.59) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL6849437 | 0.74 | ADORA3 (0.59) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL6581811 | 0.74 | ADORA3 (0.59) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL8947158 | 0.74 | ADORA3 (0.53) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL17640610 | 0.72 | CYP19A1 (0.66) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL3711268 | 0.71 | ADORA3 (0.55) | ADORA3ADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL4603583 | 0.71 | ADORA3 (0.50) | ADORA3ADORA2AADORA2BADORA1KDM4E |
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-0693061-B1 | FUNGICIDAL OXAZOLYL AND OXADIAZOLYL DERIVATIVES | ZENECA LTD (GB) | 2000-11-22 | — | — | EP | disclosed |
| US-5668160-A | Fungicidal oxazolyl and oxadiazolyl derivatives | ZENECA LIMITED (GB) | 1997-09-16 | — | — | US | disclosed |
| WO-1994022844-A1 | FUNGICIDAL OXAZOLYL AND OXADIAZOLYL DERIVATIVES | ZENECA LIMITED (GB) | 1994-10-13 | — | — | WO | disclosed |