Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | REN | P00797 | 1/20 | 0.55 |
| ▸ | CTSD | P07339 | 1/20 | 0.55 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.54 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.54 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.54 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.54 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.54 |
| ▸ | WNT3A | P56704 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL20017691 | 0.88 | ALOX5 (0.65) | NPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL498990 | 0.86 | ACHE (0.56) | ACHENPC1KMT2AHTTLMNA | |
| SCHEMBL4601794 | 0.85 | ACHE (0.73) | ACHENPC1RAB9AKMT2ALMNA | |
| SCHEMBL14814530 | 0.85 | MAPT (0.60) | ACHEKMT2ALMNAMEN1ALDH1A1 | |
| SCHEMBL19230479 | 0.85 | ACHE (0.55) | ACHENPC1KMT2AHTTLMNA | |
| SCHEMBL29803233 | 0.85 | ACHE (0.55) | ACHENPC1KMT2AHTTLMNA | |
| SCHEMBL570575 | 0.84 | LMNA (0.75) | ACHENPC1KMT2AHTTLMNA | |
| SCHEMBL7167924 | 0.84 | MAPK1 (0.69) | ACHENPC1KMT2AHTTLMNA | |
| SCHEMBL25246209 | 0.84 | CYP19A1 (0.60) | ACHENPC1KMT2AHTTLMNA | |
| SCHEMBL15988928 | 0.83 | CTNNB1 (0.77) | ACHENPC1RAB9AKMT2AMEN1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111499503-B | Method for synthesizing alpha-alkylated ketone in water | 南京理工大学 | 2022-04-08 | — | — | CN | disclosed |
| CN-111499503-A | Method for synthesizing α -alkylated ketone in water | 南京理工大学 | 2020-08-07 | — | — | CN | disclosed |
| CN-106478395-B | A kind of method of iridium catalyzed synthesizing alpha-alkyl ketone | 南京理工大学 | 2019-06-25 | — | — | CN | disclosed |
| CN-105439787-B | Method for synthesizing α -alkyl ketone | 南京理工大学 | 2018-02-13 | — | — | CN | disclosed |
| CN-106478395-A | A kind of method of iridium catalyzed synthesizing alpha-alkyl ketone | 南京理工大学 | 2017-03-08 | — | — | CN | disclosed |
| CN-105439787-A | Method for synthesizing alpha-alkyl ketone | UNIV NANJING SCIENCE & TECH | 2016-03-30 | — | — | CN | disclosed |
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |
| EP-1549600-A1 | KETONES | AstraZeneca AB (SE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004011410-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-02-05 | — | — | WO | disclosed |