Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 10/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10445051 | 0.82 | ALDH1A1 (0.41) | ARCYP2A6ALDH1A1TSHRPKM | |
| SCHEMBL1003862 | 0.78 | ALDH1A1 (0.46) | ARCYP2A6ALDH1A1TSHRPKM | |
| SCHEMBL30361887 | 0.76 | TSHR (0.52) | ARCYP2A6ALDH1A1TSHRPKM | |
| SCHEMBL277588 | 0.76 | TSHR (0.52) | ARCYP2A6ALDH1A1TSHRPKM | |
| SCHEMBL16952706 | 0.76 | FFAR1 (0.41) | ARCYP2A6ALDH1A1TSHRPKM | |
| SCHEMBL5642351 | 0.74 | IMPDH2 (0.41) | CYP2A6ALDH1A1TSHR | |
| SCHEMBL23192730 | 0.73 | AR (0.42) | ARCYP2A6ALDH1A1TSHRPKM | |
| SCHEMBL4060179 | 0.73 | AR (0.42) | ARCYP2A6ALDH1A1TSHRPKM | |
| SCHEMBL410587 | 0.73 | TRPV4 (0.57) | ARCYP2A6ALDH1A1CYP11B2MAOA | |
| SCHEMBL1343600 | 0.73 | AR (0.42) | ARCYP2A6ALDH1A1TSHRPKM |
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 |