Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL457524 | 0.78 | ALDH1A1 (0.41) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL455577 | 0.78 | ALDH1A1 (0.41) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL454901 | 0.78 | ALDH1A1 (0.41) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL456919 | 0.78 | ALDH1A1 (0.41) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL456995 | 0.78 | ALDH1A1 (0.41) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL7736209 | 0.78 | — | — | |
| SCHEMBL455612 | 0.74 | ALDH1A1 (0.38) | ALDH1A1MAPK1BACE1L3MBTL1TP53 | |
| SCHEMBL457102 | 0.74 | ALDH1A1 (0.38) | ALDH1A1MAPK1BACE1ALOX5ESR2 | |
| SCHEMBL459103 | 0.72 | ALDH1A1 (0.36) | ALDH1A1MAPK1HSD17B10HPGDMAPT | |
| SCHEMBL25862086 | 0.69 | ALDH1A1 (0.57) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 |
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 |