Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.41 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.41 |
| ▸ | ESPL1 | Q14674 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GPR174 | Q9BXC1 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 3/20 | 0.32 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL30041882 | 0.83 | ITGB1 (0.47) | ITGB1ITGA5ESPL1ALDH1A1HIF1A | |
| SCHEMBL27552998 | 0.82 | ALDH1A1 (0.41) | ITGB1ITGA5ALDH1A1HIF1AMAPT | |
| SCHEMBL27834939 | 0.81 | TDP1 (0.42) | ITGB1ITGA5ALDH1A1MAPTATM | |
| SCHEMBL28824451 | 0.81 | ATM (0.42) | ITGB1ITGA5ALDH1A1HIF1AMAPT | |
| SCHEMBL28791798 | 0.81 | ITGB1 (0.51) | ITGB1ITGA5ALDH1A1HIF1AMAPT | |
| SCHEMBL16137955 | 0.79 | ITGB1 (0.40) | ITGB1ITGA5ESPL1ALDH1A1HIF1A | |
| SCHEMBL28158467 | 0.78 | TSHR (0.40) | ITGB1ITGA5ALDH1A1MAPTTDP1 | |
| SCHEMBL1560111 | 0.77 | PDGFRB (0.47) | ITGB1ITGA5ESPL1ALDH1A1HIF1A | |
| SCHEMBL27570720 | 0.77 | ALDH1A1 (0.46) | ITGB1ITGA5ALDH1A1MAPTHTT | |
| SCHEMBL28270666 | 0.75 | ITGB1 (0.38) | ITGB1ITGA5ALDH1A1MAPTATM |
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 |
|---|---|---|---|---|---|---|---|
| CN-108164513-A | Substituted oxo pyridine derivative and its purposes in terms of cardiovascular disorder is treated | 拜耳制药股份公司 | 2018-06-15 | — | — | CN | disclosed |
| CN-105164122-A | Substituted oxopyridine derivatives and their use in the treatment of cardiovascular disorders | Bayer Pharma AG | 2015-12-16 | — | — | CN | disclosed |