Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30437851 | 0.87 | CHRNA7 (0.49) | NCOA3POLBNPC1RAB9AHRH3 | |
| SCHEMBL3505817 | 0.80 | NCOA3 (0.50) | NCOA3POLBNPC1RAB9ACHRNA7 | |
| SCHEMBL27565523 | 0.80 | CYP11B1 (0.56) | NCOA3NPC1HRH3ALDH1A1KDM4E | |
| SCHEMBL3353525 | 0.80 | EGFR (0.46) | NCOA3HRH3ALDH1A1KDM4ENOTUM | |
| SCHEMBL3665773 | 0.79 | NOTUM (0.53) | POLBNPC1RAB9AHRH3ALDH1A1 | |
| SCHEMBL18418034 | 0.78 | MET (0.53) | — | |
| SCHEMBL3974447 | 0.78 | HRH3 (0.53) | HRH3ALDH1A1KDM4EMAPTGAA | |
| SCHEMBL15065427 | 0.77 | NCOA3 (0.71) | NCOA3POLBNPC1RAB9ACHRNA7 | |
| SCHEMBL28254795 | 0.74 | HRH3 (0.50) | HRH3CHRNA7ALDH1A1KDM4ETP53 | |
| SCHEMBL4341894 | 0.73 | NOTUM (0.78) | POLBNPC1CHRNA7ALDH1A1KDM4E |
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-102958918-B | Novel tobacco amide derivatives or its salt | FUJIFILM CORP. (JP) | 2015-12-09 | — | — | CN | disclosed |