Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.33 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7173579 | 0.86 | DGKA (0.47) | ALDH1A1HDAC1HDAC2HDAC6CES2 | |
| SCHEMBL28960055 | 0.84 | HDAC6 (0.46) | ALDH1A1HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL28657457 | 0.84 | DGKA (0.50) | ALDH1A1HDAC1HDAC2HDAC6CES2 | |
| SCHEMBL30733885 | 0.84 | DGKA (0.50) | ALDH1A1HDAC1HDAC2HDAC6CES2 | |
| SCHEMBL8882125 | 0.84 | DGKA (0.50) | ALDH1A1HDAC1HDAC2HDAC6CES2 | |
| SCHEMBL28061441 | 0.84 | HDAC6 (0.36) | ALDH1A1HDAC1HDAC2HDAC6FFAR3 | |
| SCHEMBL10446 | 0.81 | ALDH1A1 (0.55) | ALDH1A1HDAC1HDAC2HDAC6CES2 | |
| SCHEMBL11667508 | 0.81 | ALDH1A1 (0.78) | ALDH1A1HDAC1HDAC2HDAC6CES2 | |
| SCHEMBL15359353 | 0.81 | HDAC6 (0.36) | ALDH1A1HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL1827760 | 0.81 | HDAC6 (0.36) | ALDH1A1HDAC1HDAC2HDAC6HDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4319746-A1 | METHODS OF TREATING METHYLMALONIC ACIDEMIA AND PROPIONIC ACIDEMIA | Hemoshear Therapeutics, Inc. (US) | 2024-02-14 | — | — | EP | disclosed |
| CN-115876926-A | Method for detecting BOC butyric acid in water and algae culture medium by using HPLC-MS/MS | 贵州健安德科技有限公司 | 2023-03-31 | — | — | CN | disclosed |
| WO-2022216848-A1 | METHODS OF TREATING METHYLMALONIC ACIDEMIA AND PROPIONIC ACIDEMIA | Hemoshear Therapeutics, Inc. (US) | 2022-10-13 | — | — | WO | disclosed |
| CN-106986837-A | A kind of preparation method of azole compounds | 湖南华腾制药有限公司 | 2017-07-28 | — | — | CN | disclosed |
| US-6576664-B1 | 1-amido-2-hydroxy-substituted-indanes; suppressing production of tumor necrosis factor | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2003-06-10 | — | — | US | disclosed |
| CN-1268117-A | Novel inhibitors of aggrecanase and matrix metalloproteinases for the treatment of arthritis | DU PONT PHARM CO (US) | 2000-09-27 | — | — | CN | disclosed |
| CN-1257482-A | Quinoline-2-carboxylic acid derivative and its use as excitatory amino acids antagonist | GLAXO WELLCOME SPA (IT) | 2000-06-21 | — | — | CN | disclosed |
| EP-1005448-A2 | NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS | Du Pont Pharmaceuticals Company (US) | 2000-06-07 | — | — | EP | disclosed |
| WO-1999009000-A2 | NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS | DU PONT PHARMACEUTICALS COMPANY (US) | 1999-02-25 | — | — | WO | disclosed |