Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | IAPP | P10997 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16960195 | 0.82 | GABRA1 (0.46) | GABRA1GABRB2PDCD1CD274ELANE | |
| SCHEMBL9839945 | 0.81 | GRM5 (0.40) | GRM5DAOGABRA1GABRB2TSHR | |
| SCHEMBL599914 | 0.79 | ESR1 (0.44) | GRM5DAOGABRA1GABRB2TSHR | |
| SCHEMBL29407427 | 0.79 | ESR1 (0.44) | GRM5DAOGABRA1GABRB2TSHR | |
| SCHEMBL135178 | 0.79 | LIPG (0.36) | DAOGABRA1GABRB2TAAR1 | |
| SCHEMBL818006 | 0.78 | KDM4E (0.35) | GRM5DAOGABRA1GABRB2TSHR | |
| SCHEMBL28168607 | 0.77 | GABRA1 (0.46) | GRM5DAOGABRA1GABRB2TSHR | |
| Ammonia Solution, Strong SCHEMBL28176469 | 0.77 | ESR1 (0.43) | GRM5DAOGABRA1GABRB2TSHR | |
| SCHEMBL16954490 | 0.77 | GABRA1 (0.46) | GRM5DAOGABRA1GABRB2TAAR1 | |
| SCHEMBL16950577 | 0.77 | CTSL (0.35) | GRM5DAOGABRA1GABRB2TAAR1 |
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 |