Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 9/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | SHBG | P04278 | 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 | |
|---|---|---|---|---|
| SCHEMBL16956476 | 0.85 | ADRB2 (0.36) | ADRB2CYP1A2 | |
| SCHEMBL16957438 | 0.83 | SLC6A4 (0.35) | SLC6A4KDM1AKCNH2KDM1B | |
| SCHEMBL16952104 | 0.82 | CES2 (0.42) | CYP1A2SHBG | |
| SCHEMBL16958465 | 0.82 | — | — | |
| SCHEMBL28835620 | 0.79 | KDM1A (0.35) | SLC6A4CYP1A2KDM1AKCNH2KDM1B | |
| SCHEMBL16956196 | 0.78 | FFAR1 (0.37) | SLC6A4CYP1A2KCNH2 | |
| SCHEMBL3611762 | 0.78 | ADRB2 (0.40) | ADRB2CYP1A2KDM1AKCNH2KDM1B | |
| SCHEMBL16954367 | 0.78 | ALDH1A1 (0.34) | SLC6A4CYP1A2KCNH2 | |
| SCHEMBL3611759 | 0.78 | ADRB2 (0.40) | ADRB2CYP1A2KDM1AKCNH2KDM1B | |
| SCHEMBL16955977 | 0.78 | SHBG (0.31) | SHBG |
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 |