Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RBP4 | P02753 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.30 |
| ▸ | FEN1 | P39748 | 1/20 | 0.30 |
| ▸ | USP1 | O94782 | 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 | |
|---|---|---|---|---|
| SCHEMBL8441351 | 0.92 | CYP3A4 (0.37) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 | |
| SCHEMBL8578758 | 0.74 | CYP1A2 (0.37) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 | |
| SCHEMBL8547752 | 0.73 | CNR2 (0.36) | ALDH1A1 | |
| SCHEMBL8327164 | 0.71 | CYP3A4 (0.36) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 | |
| SCHEMBL8578616 | 0.68 | CYP1A2 (0.33) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 | |
| SCHEMBL8580020 | 0.67 | TSHR (0.34) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 | |
| SCHEMBL23082972 | 0.65 | KMT2A (0.44) | ALDH1A1 | |
| SCHEMBL8684578 | 0.65 | HTR1A (0.38) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 | |
| Benzyl Alcohol SCHEMBL27535788 | 0.64 | CYP3A4 (0.38) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 | |
| SCHEMBL8581649 | 0.63 | CYP1A2 (0.36) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0929510-A2 | PROCESSES FOR THE PREPARATION OF ARYL-$g(b)-DIKETONES, ARYL-PYRIMIDINE KETONES AND CROP PROTECTION INTERMEDIATES | ZENECA LIMITED (GB) | 1999-07-21 | — | — | EP | disclosed |
| US-5925795-A | Processes for the preparation of aryl-β-diketones, arylpyrimidine ketones and crop protection intermediates | ZENECA LIMITED (GB) | 1999-07-20 | — | — | US | disclosed |
| EP-0927169-A1 | 4-CYCLOALKYL-5-SUBSTITUTED PYRIMIDINE COMPOUNDS USEFUL AS CROP PROTECTION AGENTS | ZENECA LIMITED (GB) | 1999-07-07 | — | — | EP | disclosed |
| WO-1998011046-A2 | PROCESSES FOR THE PREPARATION OF ARYL-β-DIKETONES, ARYL-PYRIMIDINE KETONES AND CROP PROTECTION INTERMEDIATES | ZENECA LIMITED (GB) | 1998-03-19 | — | — | WO | disclosed |
| WO-1998011074-A1 | 4-CYCLOALKYL-5-SUBSTITUTED PYRIMIDINE COMPOUNDS USEFUL AS CROP PROTECTION AGENTS | ZENECA LIMITED (GB) | 1998-03-19 | — | — | WO | disclosed |
| US-5707930-A | HERBICIDES, AGRICULTURE | ZENECA LIMITED (GB) | 1998-01-13 | — | — | US | disclosed |