Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 3/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | PRKDC | P78527 | 4/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28592231 | 1.00 | CYP2A6 (0.37) | CYP2A6MAOBMAOATTRPIN1 | |
| SCHEMBL23919117 | 0.75 | KCNA3 (0.46) | CYP2A6MAOAPIN1ALDH1A1NQO1 | |
| SCHEMBL6008 | 0.73 | MAOB (0.44) | MAOBMAOAALDH1A1KDM4EMAPT | |
| SCHEMBL29874833 | 0.73 | MAOB (0.44) | MAOBMAOAALDH1A1KDM4EMAPT | |
| SCHEMBL27290456 | 0.72 | AHR (0.49) | MAOAALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL24489802 | 0.71 | PTPN1 (0.54) | ALDH1A1MEN1KMT2APRKDCKDM4E | |
| SCHEMBL1995246 | 0.71 | CA1 (0.42) | CYP2A6PIN1ALDH1A1KMT2AKDM4E | |
| SCHEMBL30695267 | 0.70 | PTPN1 (0.53) | MAOBMAOAALDH1A1MEN1KMT2A | |
| SCHEMBL28006934 | 0.70 | PTPN1 (0.53) | MAOBMAOAALDH1A1MEN1KMT2A | |
| SCHEMBL17228470 | 0.69 | LOXL2 (0.40) | MAOBMAOAALDH1A1HIF1ACYP1B1 |
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-112876498-B | Polycyclic aromatic compound and organic electroluminescent element containing same | 北京八亿时空液晶科技股份有限公司 | 2023-04-18 | — | — | CN | disclosed |