Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27897064 | 0.94 | ALDH1A1 (0.38) | ALDH1A1LMNAMAPTTSHRKMT2A | |
| SCHEMBL27759419 | 0.80 | KMT2A (0.47) | ALDH1A1LMNAKMT2AHTTSMN1; SMN2 | |
| SCHEMBL28093354 | 0.80 | — | — | |
| SCHEMBL27759418 | 0.79 | SLC6A3 (0.50) | LMNAKMT2AHTTSMN1; SMN2L3MBTL1 | |
| SCHEMBL5975065 | 0.75 | SLC6A3 (0.46) | ALDH1A1LMNAKMT2ATDP1SLC6A3 | |
| SCHEMBL27784471 | 0.73 | SLC6A3 (0.47) | ALDH1A1LMNAKMT2AHTTPOLB | |
| SCHEMBL28193892 | 0.72 | EPHX1 (0.41) | ALDH1A1MAPTKMT2AHTTSMN1; SMN2 | |
| SCHEMBL28779591 | 0.72 | SLC6A3 (0.52) | LMNAKMT2AHTTSMN1; SMN2L3MBTL1 | |
| SCHEMBL11451574 | 0.72 | MEN1 (0.45) | LMNAKMT2AHTTPPARGMEN1 | |
| SCHEMBL301049 | 0.70 | TDP1 (0.45) | ALDH1A1LMNAMAPTTSHRKMT2A |
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-101544526-A | Method of activating alpha position C-H key of ether compound and application thereof | RENMIN UNIVERSITY OF CHINA | 2009-09-30 | — | — | CN | disclosed |