Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CCND1 | P24385 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CCND3 | P30281 | 1/20 | 0.36 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4747297 | 0.87 | HRH3 (0.42) | HRH3ADORA2AADORA1ALDH1A1HPGD | |
| SCHEMBL4786612 | 0.86 | ALDH1A1 (0.39) | HRH3ADORA2AADORA1ALDH1A1HPGD | |
| SCHEMBL4750242 | 0.85 | HRH3 (0.58) | HRH3KCNH2 | |
| SCHEMBL4750215 | 0.85 | PDGFRB (0.42) | HRH3ADORA2AADORA1ALDH1A1HPGD | |
| SCHEMBL4786809 | 0.85 | GAA (0.45) | ALDH1A1HPGDGAASMN1; SMN2HSD17B10 | |
| SCHEMBL4751106 | 0.84 | GABRG2 (0.41) | HRH3ADORA2AADORA1ALDH1A1HPGD | |
| SCHEMBL4747888 | 0.84 | MAPK13 (0.49) | HRH3ADORA2AADORA1ALDH1A1HPGD | |
| SCHEMBL4788225 | 0.82 | HRH3 (0.38) | HRH3KCNH2 | |
| SCHEMBL4788585 | 0.82 | CASP3 (0.43) | HRH3ADORA2AADORA1GAA | |
| SCHEMBL4747794 | 0.82 | POLB (0.44) | ADORA2AADORA1ALDH1A1KCNH2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008123755-A1 | A PHARMACEUTICAL COMPOSITIONS CONTAINING LACTAM TYPE PYRIDINE DERIVATIVES AS AN EFFECTIVE INGREDIENT FOR THE PREVENTION AND TREATMENT OF ISCHEMIA | SK CHEMICALS CO., LTD. (KR) | 2008-10-16 | — | — | WO | claimed |