Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 8/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 5/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL196154 | 0.98 | ALDH1A1 (0.54) | ALDH1A1ATMCES2TSHRHPGD | |
| Ammonia Solution, Strong SCHEMBL27902161 | 0.92 | CES2 (0.56) | CES2TSHRFAAHHCAR2CES1 | |
| SCHEMBL2363984 | 0.91 | CES2 (0.55) | ALDH1A1CES2TSHRFAAHHCAR2 | |
| SCHEMBL27677441 | 0.90 | ALDH1A1 (0.47) | ALDH1A1ATMCES2TSHRHPGD | |
| SCHEMBL4361492 | 0.89 | CES2 (0.58) | CES2TSHRFAAHHCAR2CES1 | |
| SCHEMBL4080844 | 0.89 | CES2 (0.58) | CES2TSHRFAAHHCAR2CES1 | |
| SCHEMBL4255348 | 0.89 | CES2 (0.58) | CES2TSHRFAAHHCAR2CES1 | |
| SCHEMBL28472787 | 0.89 | CES2 (0.58) | CES2TSHRFAAHHCAR2CES1 | |
| SCHEMBL7632794 | 0.89 | CES2 (0.53) | ALDH1A1CES2TSHRFAAHHCAR2 | |
| SCHEMBL2691990 | 0.89 | CES2 (0.58) | CES2TSHRFAAHHCAR2CES1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103833558-B | Ion liquid of quaternaries and its preparation method and application | 海洋王照明科技股份有限公司 | 2016-07-06 | — | — | CN | disclosed |
| CN-100415770-C | 2-{[N-(2-amino-3-(heteroaryl or aryl) propionyl)-aminoacyl]-amino}- alkylboronic acid derivatives | NOVARTIS AG (CH) | 2008-09-03 | — | — | CN | disclosed |
| CN-1512999-A | 2-{[N-(2-amino-3-(heteroaryl or aryl) propionyl)-aminoacyl]-amino}- alkylboronic acid derivatives | ��˹��ŵ�� | 2004-07-14 | — | — | CN | disclosed |