Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 3/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 9/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CASP2 | P42575 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL23086233 | 0.85 | EPHX1 (0.56) | NAAAEPHX1CASP2DPP7ALDH1A1 | |
| Benzene SCHEMBL28591011 | 0.83 | EPHX1 (0.59) | NAAAEPHX1CASP2ALDH1A1HTT | |
| SCHEMBL28947 | 0.83 | — | — | |
| SCHEMBL8007143 | 0.83 | EPHX1 (0.62) | NAAAEPHX1CASP2DPP7 | |
| Pyrimidine SCHEMBL27454358 | 0.83 | NAAA (0.41) | NAAAEPHX1KDM4ECASP2ALOX12 | |
| SCHEMBL19468513 | 0.81 | EPHX1 (0.67) | NAAAEPHX1CASP2DPP7 | |
| SCHEMBL19468503 | 0.81 | EPHX1 (0.67) | NAAAEPHX1CASP2DPP7 | |
| SCHEMBL2185171 | 0.81 | EPHX1 (0.67) | NAAAEPHX1CASP2DPP7 | |
| SCHEMBL76613 | 0.81 | EPHX1 (0.67) | NAAAEPHX1CASP2DPP7 | |
| SCHEMBL19468457 | 0.81 | EPHX1 (0.67) | NAAAEPHX1CASP2DPP7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114364666-A | Substituted N-phenyl-N-semicarbazides pyrimidines and salts thereof and their use as herbicides | 拜耳公司 | 2022-04-15 | — | — | CN | disclosed |