Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | FABP2 | P12104 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL457364 | 0.78 | ALDH1A1 (0.44) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL10428951 | 0.78 | BACE1 (0.36) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL14675940 | 0.75 | ESR2 (0.38) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL455577 | 0.75 | ALDH1A1 (0.41) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL456995 | 0.75 | ALDH1A1 (0.41) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL7814278 | 0.75 | CYP2A6 (0.41) | ALDH1A1MAPK1BACE1ALOX5HSD17B10 | |
| SCHEMBL455612 | 0.71 | ALDH1A1 (0.38) | ALDH1A1MAPK1BACE1MEN1KMT2A | |
| SCHEMBL457978 | 0.71 | TP53 (0.32) | BACE1ALOX5HPGDPTGS1MEN1 | |
| SCHEMBL456741 | 0.69 | KDM4E (0.31) | ALDH1A1HSD17B10HPGDMEN1KMT2A | |
| SCHEMBL457803 | 0.68 | ADORA3 (0.33) | ALDH1A1HSD17B10HPGDPTGS1MEN1 |
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 |