Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | PDE2A | O00408 | 1/20 | 0.43 |
| ▸ | PDE5A | O76074 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.43 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.43 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16957017 | 0.83 | ALDH1A1 (0.58) | ALDH1A1TSHRTDP1CYP3A4PDE2A | |
| SCHEMBL16960626 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TSHRTDP1CYP3A4MAPT | |
| SCHEMBL16953738 | 0.81 | POLB (0.41) | ALDH1A1TSHRTDP1CYP3A4MAPT | |
| SCHEMBL16951755 | 0.80 | HSD17B10 (0.55) | ALDH1A1TSHRTDP1CYP3A4NFKB1 | |
| SCHEMBL16953608 | 0.80 | PTPRC (0.41) | ALDH1A1TSHRTDP1CYP3A4PDE7A | |
| SCHEMBL16958616 | 0.80 | ALDH1A1 (0.51) | ALDH1A1TSHRTDP1MAPTGAA | |
| SCHEMBL16958012 | 0.80 | LMNA (0.42) | ALDH1A1TSHRTDP1ALOX15MAPT | |
| SCHEMBL16954561 | 0.80 | TXNRD1 (0.42) | ALDH1A1TSHRTDP1CYP3A4PDE7A | |
| SCHEMBL16962137 | 0.80 | TDP1 (0.54) | ALDH1A1TDP1CYP3A4MAPTLMNA | |
| SCHEMBL12929973 | 0.79 | ALDH1A1 (0.62) | ALDH1A1TSHRTDP1CYP3A4PDE2A |
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 |