Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 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 | |
|---|---|---|---|---|
| Cyclooctane SCHEMBL21693719 | 0.83 | TDP1 (0.81) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28788230 | 0.77 | TDP1 (0.68) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28876682 | 0.76 | TDP1 (0.48) | TDP1HSD17B10 | |
| SCHEMBL60399 | 0.75 | — | — | |
| SCHEMBL518261 | 0.75 | HSD17B10 (0.52) | HSD17B10TSHR | |
| SCHEMBL1521924 | 0.75 | — | — | |
| SCHEMBL2638 | 0.75 | — | — | |
| SCHEMBL463775 | 0.75 | HSD17B10 (0.52) | HSD17B10TSHR | |
| SCHEMBL20055722 | 0.75 | HSD17B10 (0.52) | HSD17B10TSHR | |
| Tert-Butyl Formate SCHEMBL1671 | 0.75 | — | — |
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-106458992-A | Pyridyl piperidines | 默克专利股份公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-103857393-B | Cyclopropylamine is as LSD1 inhibitor | 葛兰素史密斯克莱知识产权（第2 号）有限公司 | 2016-08-17 | — | — | CN | disclosed |