Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL457803 | 0.81 | ADORA3 (0.33) | ESR2ADORA3ADORA2AADORA1PSMB5 | |
| SCHEMBL457437 | 0.81 | ADORA3 (0.33) | ADORA3ADORA2AADORA1PSMB5SMN1; SMN2 | |
| SCHEMBL456773 | 0.81 | CYP2A6 (0.35) | ESR2ADORA3ADORA2AADORA1PSMB5 | |
| SCHEMBL457181 | 0.78 | ADRB2 (0.33) | ADORA3ADORA2AADORA1MAPTALDH1A1 | |
| SCHEMBL4371389 | 0.72 | ESR2 (0.41) | ESR2PDCD1CD274PSMB5CYP2A6 | |
| SCHEMBL4155256 | 0.72 | PSMB5 (0.38) | PSMB5HSD11B1TSHRGCGR | |
| SCHEMBL6206554 | 0.69 | CYP2A6 (0.41) | ESR2PDCD1CD274CYP2A6CYP2B6 | |
| SCHEMBL456995 | 0.69 | ALDH1A1 (0.41) | ESR2PDCD1CD274CYP2A6CYP2B6 | |
| SCHEMBL456233 | 0.69 | ESR2 (0.38) | ESR2ADORA3ADORA2AADORA1PDCD1 | |
| SCHEMBL456470 | 0.68 | TP53 (0.34) | ESR2ADORA3ADORA2AADORA1PDCD1 |
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 |