Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PSMB1 | P20618 | 2/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.40 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL28039833 | 0.79 | TDP1 (0.42) | TDP1ALDH1A1SMN1; SMN2HRH3HSD17B10 | |
| SCHEMBL27978453 | 0.79 | HRH3 (0.52) | PSMB1PSMB5PSMB2SMN1; SMN2HRH3 | |
| Tert-Butyl Formate SCHEMBL28258224 | 0.79 | TDP1 (0.45) | MEN1GAAMAPTKMT2ATDP1 | |
| Tert-Butyl Formate SCHEMBL27725494 | 0.79 | TDP1 (0.45) | MEN1GAAMAPTKMT2ATDP1 | |
| Tert-Butyl Formate SCHEMBL27906317 | 0.79 | TDP1 (0.45) | MEN1GAAMAPTKMT2ATDP1 | |
| Tert-Butyl Formate SCHEMBL28546443 | 0.78 | TDP1 (0.48) | TDP1CYP1A2CYP2D6CYP2C19HSD17B10 | |
| Tert-Butyl Formate SCHEMBL28297830 | 0.78 | HRH3 (0.42) | TDP1ALDH1A1HRH3MAOB | |
| Tert-Butyl Formate SCHEMBL27621319 | 0.76 | TDP1 (0.50) | KMT2ATDP1PSMB1PSMB5PSMB2 | |
| Tert-Butyl Formate SCHEMBL28876682 | 0.75 | TDP1 (0.48) | TDP1PSMB1PSMB5PSMB2KDM4E | |
| Tert-Butyl Formate SCHEMBL27773484 | 0.75 | TDP1 (0.48) | TDP1PSMB1PSMB5PSMB2KDM4E |
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-104011054-B | As the thieno of potassium channel inhibitors and Furanopyrimidines class and pyridines | 森申有限公司 | 2016-08-24 | — | — | CN | disclosed |