Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 8/20 | 0.63 |
| ▸ | PDK2 | Q15119 | 8/20 | 0.63 |
| ▸ | PDK3 | Q15120 | 8/20 | 0.63 |
| ▸ | PDK4 | Q16654 | 8/20 | 0.63 |
| ▸ | ABCC9 | O60706 | 3/20 | 0.50 |
| ▸ | ABCC8 | Q09428 | 3/20 | 0.50 |
| ▸ | KCNJ11 | Q14654 | 3/20 | 0.50 |
| ▸ | KCNJ8 | Q15842 | 3/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8322930 | 0.85 | PDK1 (0.60) | PDK1PDK2PDK3PDK4ABCC9 | |
| SCHEMBL14086870 | 0.83 | PDK1 (0.62) | PDK1PDK2PDK3PDK4ABCC9 | |
| SCHEMBL14086869 | 0.83 | PDK1 (0.62) | PDK1PDK2PDK3PDK4ABCC9 | |
| SCHEMBL11874543 | 0.82 | PDK1 (0.57) | PDK1PDK2PDK3PDK4ABCC9 | |
| SCHEMBL12591123 | 0.81 | PDK1 (0.59) | PDK1PDK2PDK3PDK4ABCC9 | |
| SCHEMBL18171744 | 0.80 | AR (0.54) | PDK1PDK2PDK3PDK4HDAC1 | |
| SCHEMBL8575413 | 0.80 | PDK1 (0.54) | PDK1PDK2PDK3PDK4ABCC9 | |
| SCHEMBL14086879 | 0.79 | PDK1 (0.57) | PDK1PDK2PDK3PDK4ABCC9 | |
| SCHEMBL14273995 | 0.79 | PDK1 (0.57) | PDK1PDK2PDK3PDK4L3MBTL1 | |
| SCHEMBL14086866 | 0.79 | PDK1 (0.57) | PDK1PDK2PDK3PDK4ABCC9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115701991-A | Pyrazolylpropionamide compounds and their use for treating prostate cancer | 田纳西大学研究基金会 | 2023-02-14 | — | — | CN | disclosed |
| CN-101891663-A | Preparation method of bicalutamide intermediate | Hangzhou minsheng pharmaceutical group co ltd | 2010-11-24 | — | — | CN | disclosed |
| CN-1413188-A | Resolution of intermediates in synthesis of substantially pure bicalutamide | NOBEX CORP (US) | 2003-04-23 | — | — | CN | disclosed |
| CN-1409702-A | Methods for asymmetrically synthesizing enantiomer of casodex, its derivatives and intermediate thereof | NOBEX CORP (US) | 2003-04-09 | — | — | CN | disclosed |