Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.60 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.51 |
| ▸ | AHR | P35869 | 3/20 | 0.51 |
| ▸ | NR1I3 | Q14994 | 3/20 | 0.51 |
| ▸ | VDR | P11473 | 2/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.50 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL27862687 | 0.84 | CYP1A2 (0.60) | ALOX5GPR84CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL10013792 | 0.83 | ALOX5 (0.52) | ALOX5GPR84CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL29587463 | 0.83 | CYP1A2 (0.64) | CYP1A2CYP2C9CYP3A4CYP2B6AHR | |
| SCHEMBL601233 | 0.83 | CYP1A2 (0.64) | CYP1A2CYP2C9CYP3A4CYP2B6AHR | |
| SCHEMBL31411912 | 0.82 | KMT2A (0.51) | ALOX5GPR84CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL12583245 | 0.82 | GPR84 (0.61) | ALOX5GPR84CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL21615639 | 0.82 | GPR84 (0.61) | ALOX5GPR84CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL18762062 | 0.81 | ALOX5 (0.58) | ALOX5GPR84CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL29847407 | 0.81 | ALOX5 (0.58) | ALOX5GPR84CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL15366516 | 0.81 | CYP1A2 (0.61) | ALOX5GPR84CYP1A2CYP2C9CYP3A4 |
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-113860984-A | Magnesium-activated ligand-promoted chromium-catalyzed polycyclic aromatic hydrocarbon and olefin regioselective hydrogenation method | 延安大学 | 2021-12-31 | — | — | CN | disclosed |
| CN-107216229-A | A kind of method of chromic salts/methyl-magnesium-bromide selective catalytic hydrogenation polycyclic aromatic hydrocarbon | 四川大学 | 2017-09-29 | — | — | CN | disclosed |