Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.30 |
| ▸ | GOPC | Q9HD26 | 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 | |
|---|---|---|---|---|
| SCHEMBL455859 | 0.76 | APP (0.31) | ALDH1A1SIGMAR1CFTRGOPC | |
| SCHEMBL3982745 | 0.75 | ALDH1A1 (0.47) | CYP1A2ALDH1A1SIGMAR1CFTRGOPC | |
| SCHEMBL456779 | 0.72 | TP53 (0.31) | — | |
| SCHEMBL455952 | 0.68 | APP (0.34) | CYP1A2ALDH1A1SIGMAR1CFTRGOPC | |
| SCHEMBL457003 | 0.68 | ALDH1A1 (0.33) | CYP1A2CYP2A6ALDH1A1SIGMAR1CFTR | |
| SCHEMBL24514949 | 0.66 | ALDH1A1 (0.36) | ALDH1A1SIGMAR1CFTRGOPC | |
| SCHEMBL14192246 | 0.66 | CYP3A4 (0.64) | CYP1A2ALDH1A1 | |
| SCHEMBL13750195 | 0.66 | ALDH1A1 (0.36) | ALDH1A1SIGMAR1CFTRGOPC | |
| SCHEMBL23260378 | 0.65 | PTPN1 (0.33) | CYP1A2ALDH1A1SIGMAR1CFTRGOPC | |
| SCHEMBL458387 | 0.64 | ALDH1A1 (0.33) | ALDH1A1 |
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-2614053-A1 | METHOD FOR PRODUCING PYRIDAZINONE COMPOUNDS AND INTERMEDIATE THEREOF | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 2013-07-17 | — | — | EP | disclosed |
| WO-2012033225-A1 | METHOD FOR PRODUCING PYRIDAZINONE COMPOUNDS AND INTERMEDIATE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-03-15 | — | — | WO | disclosed |