Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 6/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | PTGIR | P43119 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL21295951 | 0.88 | GPR3 (0.42) | GPR3RAB9AKDM4ENPC1MAPT | |
| SCHEMBL21879689 | 0.87 | GPR3 (0.48) | GPR3RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL21879645 | 0.84 | NPC1 (0.41) | GPR3RAB9AKDM4ENPC1MAPT | |
| SCHEMBL28570307 | 0.78 | GABRA1 (0.44) | GPR3RAB9AKDM4ENPC1MAPT | |
| SCHEMBL28304152 | 0.72 | RAB9A (0.50) | GPR3RAB9AKDM4ENPC1MAPT | |
| SCHEMBL26813480 | 0.72 | GPR3 (0.45) | GPR3RAB9AKDM4ENPC1MAPT | |
| SCHEMBL28573918 | 0.70 | GPR3 (0.52) | GPR3RAB9AKDM4ENPC1MAPT | |
| SCHEMBL8964456 | 0.70 | GPR3 (0.52) | GPR3RAB9AKDM4ENPC1MAPT | |
| SCHEMBL21300530 | 0.70 | MAPT (0.40) | RAB9AKDM4ENPC1MAPTALDH1A1 | |
| Dibenzothiophene SCHEMBL28647613 | 0.68 | GPR3 (0.67) | GPR3RAB9AKDM4ENPC1MAPT |
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-109311844-B | Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component | 东曹株式会社 | 2021-07-20 | — | — | CN | disclosed |
| CN-112912372-A | Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element | 东曹株式会社 | 2021-06-04 | — | — | CN | disclosed |