Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5208296 | 0.89 | — | — | |
| SCHEMBL5208244 | 0.85 | CHRNB2 (0.33) | CHRNB2CHRNB4CHRNA4LMNAALDH1A1 | |
| SCHEMBL5206280 | 0.82 | — | — | |
| SCHEMBL5207687 | 0.78 | CHRNB2 (0.37) | CHRNB2CHRNB4CHRNA4LMNAALDH1A1 | |
| SCHEMBL5211212 | 0.77 | CHRNB2 (0.40) | CHRNB2CHRNB4CHRNA4LMNAALDH1A1 | |
| SCHEMBL5209126 | 0.75 | LMNA (0.38) | CHRNB2CHRNB4CHRNA4LMNAALDH1A1 | |
| SCHEMBL5208753 | 0.75 | CHRNB2 (0.35) | CHRNB2CHRNB4CHRNA4LMNAALDH1A1 | |
| SCHEMBL5209578 | 0.74 | EPHX2 (0.36) | CHRNB2CHRNB4CHRNA4LMNAALDH1A1 | |
| SCHEMBL5209651 | 0.74 | — | — | |
| SCHEMBL497832 | 0.74 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0958292-B1 | 4-(3-HETEROCYCLYL-1-BENZOYL)PYRAZOLES AND THEIR USE AS HERBICIDES | BASF AG (DE) | 2007-01-03 | — | — | EP | disclosed |
| US-6165944-A | 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2000-12-26 | — | — | US | disclosed |