Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 5/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.40 |
| ▸ | ERN1 | O75460 | 3/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27661280 | 0.85 | ALDH1A1 (0.61) | ALDH1A1MEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL28237787 | 0.84 | MEN1 (0.49) | ALDH1A1MEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL27810256 | 0.84 | ALDH1A1 (0.59) | ALDH1A1MEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL27304277 | 0.82 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL28325692 | 0.80 | ABCG2 (0.40) | ALDH1A1KDM4ECYP1A2HPGDESR1 | |
| SCHEMBL27785364 | 0.80 | NPC1 (0.47) | ALDH1A1MEN1KMT2AKDM4EGLA | |
| SCHEMBL11770118 | 0.78 | ERN1 (0.50) | GRIN2DGRIN2AGRIN2BGRIN2CERN1 | |
| SCHEMBL27452198 | 0.77 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL27807281 | 0.77 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL5427708 | 0.77 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2AKDM4ECYP1A2 |
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-105051019-B | Compound, electron transport material, and organic electroluminescent element using the electron transport material | 捷恩智株式会社 | 2018-06-12 | — | — | CN | disclosed |
| CN-105051019-A | Electron transport material and organic electroluminescent element using the same | JNC CORP | 2015-11-11 | — | — | CN | disclosed |