Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 5/20 | 0.40 |
| ▸ | CES2 | O00748 | 9/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Butanone SCHEMBL28064478 | 0.97 | ALDH1A1 (0.65) | ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10 | |
| Butanone SCHEMBL1454065 | 0.97 | ALDH1A1 (0.65) | ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10 | |
| Butanone SCHEMBL27524123 | 0.94 | ALDH1A1 (0.61) | ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10 | |
| Butanone SCHEMBL9706895 | 0.94 | ALDH1A1 (0.61) | ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10 | |
| Butanone SCHEMBL7611681 | 0.94 | ALDH1A1 (0.61) | ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10 | |
| Heptane SCHEMBL27952429 | 0.92 | ALDH1A1 (0.60) | ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10 | |
| Butanone SCHEMBL16699494 | 0.92 | ALDH1A1 (0.58) | ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL148760 | 0.91 | — | — | |
| Butyl Alcohol SCHEMBL27615272 | 0.91 | ALDH1A1 (0.73) | ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL27390375 | 0.91 | ALDH1A1 (0.73) | ALDH1A1TDP1SMN1; SMN2LMNAHSD17B10 |
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-102834370-B | The preparation method of 1-amino-1-alkoxy carbonyl-2-vinylcyclopropane | 株式会社API | 2016-11-23 | — | — | CN | disclosed |
| CN-105802209-A | Solution of aromatic polyamide for producing display element, optical element, illumination element or sensor element | 亚克朗聚合物系统公司 | 2016-07-27 | — | — | CN | disclosed |