Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CES2 | O00748 | 3/20 | 0.51 |
| ▸ | CES1 | P23141 | 3/20 | 0.51 |
| ▸ | NAAA | Q02083 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.45 |
| ▸ | CTSG | P08311 | 2/20 | 0.45 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.45 |
| ▸ | CMA1 | P23946 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11129975 | 0.95 | NAAA (0.54) | ALDH1A1KMT2APOLBMAPTCES2 | |
| SCHEMBL15993619 | 0.94 | NAAA (0.56) | ALDH1A1KMT2APOLBMAPTCES2 | |
| SCHEMBL26929523 | 0.92 | NAAA (0.55) | ALDH1A1KMT2APOLBMAPTCES2 | |
| SCHEMBL6886046 | 0.90 | ALDH1A1 (0.58) | ALDH1A1KMT2APOLBMAPTCES2 | |
| SCHEMBL8459980 | 0.87 | ALDH1A1 (0.54) | ALDH1A1KMT2APOLBMAPTKDM4E | |
| SCHEMBL27556286 | 0.86 | ALDH1A1 (0.66) | ALDH1A1KMT2APOLBMAPTCES1 | |
| SCHEMBL28102734 | 0.86 | LMNA (0.50) | ALDH1A1KMT2APOLBMAPTKDM4E | |
| SCHEMBL9574878 | 0.86 | POLB (0.61) | ALDH1A1POLBCES2CES1NAAA | |
| SCHEMBL27540289 | 0.84 | HDAC3 (0.54) | ALDH1A1KMT2APOLBMAPTKDM4E | |
| SCHEMBL27793167 | 0.84 | SMN1; SMN2 (0.42) | ALDH1A1KMT2APOLBMAPTCES2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117255626-A | Amide compounds and their use as flavor modifiers | 弗门尼舍公司 | 2023-12-19 | — | — | CN | disclosed |
| CN-105001098-A | Method for preparing 3(R)/(S)-amidogen-1-butanol | SHENGZHOU OIL CHEMICAL CO LTD | 2015-10-28 | — | — | CN | disclosed |
| CN-104961640-A | Preparation method of optically pure 3-amino-1-butanol | SHENGZHOU GREASE AND CHEMICAL CO LTD | 2015-10-07 | — | — | CN | disclosed |
| CN-100475786-C | 4-hydroxypentanamide compound and preparation method and application thereof | SHANGHAI INST MATERIA MEDICA (CN) | 2009-04-08 | — | — | CN | disclosed |
| CN-1757635-A | 4-hydroxypentanamide compound and preparation method and application thereof | SHANGHAI PHARMACEUTICAL INST C (CN) | 2006-04-12 | — | — | CN | disclosed |
| CN-1056141-C | Piperazine derivatives | MERCK PATENT GESELLSCHAFTR MIT (DE) | 2000-09-06 | — | — | CN | disclosed |
| CN-1099759-A | Piperazine derivatives | MERCK PATENT GMBH (DE) | 1995-03-08 | — | — | CN | disclosed |