Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.55 |
| ▸ | MAOA | P21397 | 3/20 | 0.45 |
| ▸ | MAOB | P27338 | 3/20 | 0.45 |
| ▸ | LTA4H | P09960 | 4/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.40 |
| ▸ | CHRNA10 | Q9GZZ6 | 2/20 | 0.40 |
| ▸ | CHRNA9 | Q9UGM1 | 2/20 | 0.40 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.39 |
| ▸ | ATP4A | P20648 | 1/20 | 0.39 |
| ▸ | ATP4B | P51164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16953265 | 0.88 | NQO1 (0.45) | AHRLTA4HNR5A1PLA2G2ALMNA | |
| SCHEMBL23457915 | 0.85 | AHR (0.65) | AHRMAOAMAOBLTA4HCHRNA7 | |
| SCHEMBL26976511 | 0.85 | AHR (0.65) | AHRMAOAMAOBLTA4HCHRNA7 | |
| SCHEMBL16957654 | 0.85 | KDM4E (0.43) | AHRLTA4HNR5A1PLA2G2ATSHR | |
| SCHEMBL16954496 | 0.84 | ESR1 (0.50) | AHRESR1TSHRSMN1; SMN2ALDH1A1 | |
| SCHEMBL16951596 | 0.83 | CA12 (0.41) | AHRLTA4HNR5A1TSHRCYP3A4 | |
| SCHEMBL16953810 | 0.82 | CNR1 (0.40) | AHRLTA4HNR5A1PLA2G2ASMN1; SMN2 | |
| SCHEMBL16959969 | 0.81 | LTA4H (0.40) | AHRLTA4HNR5A1PLA2G2ATSHR | |
| SCHEMBL16958654 | 0.81 | LTA4H (0.42) | AHRLTA4HNR5A1LMNATSHR | |
| SCHEMBL16955656 | 0.81 | LTA4H (0.40) | AHRLTA4HNR5A1PLA2G2ALMNA |
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 |