Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.40 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28586495 | 1.00 | PARP10 (0.40) | PARP10PARP11FYNCLK4DYRK1B | |
| SCHEMBL28586497 | 1.00 | PARP10 (0.40) | PARP10PARP11FYNCLK4DYRK1B | |
| SCHEMBL28590451 | 0.88 | CA12 (0.34) | GAAHRH3ALDH1A1HPGDMAPT | |
| SCHEMBL29629328 | 0.88 | CA12 (0.34) | GAAHRH3ALDH1A1HPGDMAPT | |
| SCHEMBL28590447 | 0.88 | CA12 (0.34) | GAAHRH3ALDH1A1HPGDMAPT | |
| SCHEMBL30731535 | 0.88 | HRH3 (0.44) | PARP10PARP11PGRGAAHRH3 | |
| SCHEMBL29279612 | 0.88 | HRH3 (0.44) | PARP10PARP11PGRGAAHRH3 | |
| SCHEMBL28585931 | 0.81 | GRIA1 (0.43) | CLK4HRH3ALDH1A1CYP3A4MAPK1 | |
| SCHEMBL29629331 | 0.81 | GRIA1 (0.43) | CLK4HRH3ALDH1A1CYP3A4MAPK1 | |
| SCHEMBL28585932 | 0.81 | GRIA1 (0.43) | CLK4HRH3ALDH1A1CYP3A4MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112898259-B | Method for preparing 3-substituted chromanone through nonmetal catalytic hydrogenation | 中国科学院化学研究所 | 2022-05-17 | — | — | CN | disclosed |