Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.34 |
| ▸ | KAT6A | Q92794 | 6/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | VCP | P55072 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 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 | |
|---|---|---|---|---|
| SCHEMBL9756866 | 0.81 | CYP2A6 (0.35) | CYP2A6CLK4DYRK1AADRB2KAT6A | |
| SCHEMBL18486761 | 0.78 | FFAR1 (0.32) | CLK4DYRK1AFFAR1 | |
| SCHEMBL13539329 | 0.78 | CYP2A6 (0.48) | CYP2A6CLK4DYRK1AADRB2KAT6A | |
| SCHEMBL1359976 | 0.77 | GRM5 (0.44) | CYP2A6CES2CES1CLK4DYRK1A | |
| SCHEMBL6642380 | 0.76 | NOTUM (0.47) | CYP2A6CLK4DYRK1AADRB2KAT6A | |
| SCHEMBL9756905 | 0.76 | CLK4 (0.47) | CLK4 | |
| SCHEMBL20456773 | 0.76 | KAT6A (0.36) | CYP2A6CLK4DYRK1AKAT6AVCP | |
| SCHEMBL9763829 | 0.75 | HDAC4 (0.35) | CES2CES1GRIN1GRIN2BHRH4 | |
| SCHEMBL16193051 | 0.74 | NAPRT (0.40) | KAT6AVCPHDAC4 | |
| SCHEMBL20033410 | 0.74 | CLK4 (0.36) | CLK4DYRK1AFFAR1AOC3 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117924246-A | Pi conjugated compound, organic electroluminescent element material, luminescent thin film, organic electroluminescent element, display device, and lighting device | 默克专利有限公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-106632488-A | Sterically-hindered pyrimidine iridium complex phosphorescence material and preparation method thereof | 安徽工业大学 | 2017-05-10 | — | — | CN | disclosed |
| CN-104293342-A | Blue-light organic electrophosphorescent material, preparation method and application thereof | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |
| CN-104293342-A | Blue-light organic electrophosphorescent material, preparation method and application thereof | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |
| CN-104293341-A | Blue phosphorescent iridium metal complex, preparation method thereof and organic electroluminescent device | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |
| CN-104293341-A | Blue phosphorescent iridium metal complex, preparation method thereof and organic electroluminescent device | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |
| CN-104293343-A | Blue-light organic electrophosphorescent material, preparation method and application thereof | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |
| CN-104293344-A | Blue phosphorescent iridium metal complex, preparation method thereof and organic electroluminescent device | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |
| CN-104293345-A | Blue organic electrophosphorescent material, and preparation method and application thereof | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |
| CN-104293344-A | Blue phosphorescent iridium metal complex, preparation method thereof and organic electroluminescent device | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |
| CN-104293345-A | Blue organic electrophosphorescent material, and preparation method and application thereof | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |
| CN-104293343-A | Blue-light organic electrophosphorescent material, preparation method and application thereof | OCEANS KING LIGHTING SCIENCE | 2015-01-21 | — | — | CN | disclosed |