Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 3/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16951629 | 0.86 | GABRA1 (0.38) | CA12CA1CA2CA14 | |
| SCHEMBL16953873 | 0.85 | ELANE (0.37) | ELANE | |
| SCHEMBL10600231 | 0.81 | ALOX5 (0.43) | ALOX5PTGS2CA12CA1CA2 | |
| SCHEMBL16954576 | 0.81 | AR (0.34) | — | |
| SCHEMBL16953027 | 0.81 | MAPT (0.35) | — | |
| SCHEMBL16959184 | 0.77 | ALOX5 (0.38) | ALOX5PTGS2CA12CA1CA2 | |
| SCHEMBL16951875 | 0.77 | GRM5 (0.33) | — | |
| SCHEMBL16957143 | 0.75 | TAAR1 (0.36) | PPARA | |
| SCHEMBL16958669 | 0.75 | GABRA1 (0.42) | — | |
| SCHEMBL16956359 | 0.75 | CTSL (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |