Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.36 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.36 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.36 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8132186 | 0.88 | CA12 (0.36) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL8598024 | 0.81 | CFTR (0.40) | HSD17B10CA1CA2CA9VCAM1 | |
| SCHEMBL8164153 | 0.79 | EDNRA (0.41) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL4273679 | 0.77 | PSMB8 (0.38) | HSD17B10ALDH1A1MAPTCA1CA2 | |
| SCHEMBL27561142 | 0.75 | RAB9A (0.36) | KMT2AHSD17B10ALDH1A1MAPTCA1 | |
| SCHEMBL4269505 | 0.75 | SMN1; SMN2 (0.33) | HSD17B10MAPTCA1CA2CA9 | |
| SCHEMBL8175098 | 0.75 | GAA (0.42) | KMT2AHSD17B10MAPTCA1CA2 | |
| SCHEMBL7946301 | 0.75 | ACLY (0.44) | KMT2AHSD17B10ALDH1A1MAPTCA1 | |
| SCHEMBL4274890 | 0.73 | VCAM1 (0.33) | CYP3A4CYP2D6KMT2AHSD17B10ALDH1A1 | |
| SCHEMBL8135182 | 0.73 | MEN1 (0.41) | KMT2AALDH1A1MAPTTSHRKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1104429-C | 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides | BASF AG (DE) | 2003-04-02 | — | — | CN | disclosed |
| US-6165944-A | 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2000-12-26 | — | — | US | disclosed |
| CN-1250447-A | 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides | BASF AG (DE) | 2000-04-12 | — | — | CN | disclosed |