Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 2/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.31 |
| ▸ | GPR3 | P46089 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ACACB | O00763 | 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 | |
|---|---|---|---|---|
| SCHEMBL16958829 | 0.86 | PTGS2 (0.35) | FFAR1CHRM2CHRM1CHRM3PTGS2 | |
| SCHEMBL16958159 | 0.84 | ACACB (0.35) | FFAR1PDE2AACACB | |
| SCHEMBL16954164 | 0.83 | GPR3 (0.35) | FFAR1GPR3GRM5 | |
| SCHEMBL16961413 | 0.81 | L3MBTL1 (0.43) | TSHRL3MBTL1MRGPRX4PDE2A | |
| SCHEMBL21190211 | 0.81 | TSHR (0.41) | TSHRGRIN2BCHRM2CHRM1CHRM3 | |
| SCHEMBL16959054 | 0.80 | PTGS2 (0.39) | TSHRGRIN2BGRIN1PTGS2ALDH1A1 | |
| SCHEMBL16957167 | 0.79 | NQO1 (0.41) | TSHRCHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL16955222 | 0.79 | ALDH1A1 (0.41) | GRIN2BL3MBTL1PTGS1GPR3GRM5 | |
| SCHEMBL16954880 | 0.78 | RXRA (0.33) | GRIN2BRXRAGRIN1ACACB | |
| SCHEMBL16956812 | 0.77 | CYP2A6 (0.36) | RXRAPTGS2 |
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 |