Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | DRD1 | P21728 | 1/20 | 0.30 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL131082 | 0.74 | ALDH1A1 (0.55) | TSHRTDP1MEN1ALDH1A1KMT2A | |
| SCHEMBL14223535 | 0.72 | ALDH1A1 (0.39) | CYP3A4MAPK1TDP1MEN1ALDH1A1 | |
| SCHEMBL5413852 | 0.72 | CYP3A4 (0.36) | CYP3A4MAPK1TDP1MEN1ALDH1A1 | |
| SCHEMBL189622 | 0.72 | ALDH1A1 (0.59) | CYP3A4MAPK1TSHRTDP1MEN1 | |
| SCHEMBL172044 | 0.72 | CYP3A4 (0.36) | CYP3A4MAPK1TDP1MEN1ALDH1A1 | |
| SCHEMBL5803125 | 0.72 | CA12 (0.42) | CYP3A4MAPK1TSHRTDP1MEN1 | |
| SCHEMBL5803124 | 0.72 | CA12 (0.42) | CYP3A4MAPK1TSHRTDP1MEN1 | |
| SCHEMBL16959052 | 0.70 | CYP3A4 (0.46) | CYP3A4MAPK1TSHRTDP1CYP2A6 | |
| SCHEMBL29368277 | 0.67 | CYP3A4 (0.62) | CYP3A4MAPK1TSHRTDP1ALDH1A1 | |
| SCHEMBL348089 | 0.67 | CYP3A4 (0.62) | CYP3A4MAPK1TSHRTDP1ALDH1A1 |
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 |