Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A1 | P22736 | 1/20 | 0.50 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.50 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.50 |
| ▸ | CDC25B | P30305 | 1/20 | 0.44 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | PLK1 | P53350 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14977560 | 0.88 | NR4A1 (0.52) | NR4A1NR4A2NR4A3CDC25BPTK2B | |
| SCHEMBL84200 | 0.75 | AKT1 (0.56) | L3MBTL1ALDH1A1HPGDSMN1; SMN2AKT1 | |
| SCHEMBL9422531 | 0.75 | AKT1 (0.56) | L3MBTL1ALDH1A1HPGDSMN1; SMN2AKT1 | |
| SCHEMBL31371895 | 0.75 | NR4A1 (0.55) | NR4A1NR4A2NR4A3CDC25BPTK2B | |
| SCHEMBL7941531 | 0.75 | PTK2B (0.52) | NR4A1NR4A2NR4A3CDC25BPTK2B | |
| SCHEMBL1933651 | 0.75 | NR4A1 (0.55) | NR4A1NR4A2NR4A3CDC25BPTK2B | |
| SCHEMBL5012386 | 0.74 | NR4A1 (0.59) | NR4A1NR4A2NR4A3CDC25BPTK2B | |
| SCHEMBL40515 | 0.74 | NR4A1 (0.59) | NR4A1NR4A2NR4A3CDC25BPTK2B | |
| SCHEMBL29465774 | 0.73 | NR4A1 (0.59) | NR4A1NR4A2NR4A3CDC25BPTK2B | |
| SCHEMBL726189 | 0.73 | NR4A1 (0.59) | NR4A1NR4A2NR4A3CDC25BPTK2B |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1754475-A1 | Use of C-terminal modified oxamyl dipeptides as inhibitors of the ice/ced-3 family of cysteine proteases | Idun Pharmaceuticals, Inc. (US) | 2007-02-21 | — | — | EP | claimed |
| JP-3815968-B2 | — | — | 2006-08-30 | — | — | JP | claimed |
| JP-2002519406-A | — | — | 2002-07-02 | — | — | JP | claimed |
| EP-1091930-A1 | C-TERMINAL MODIFIED OXAMYL DIPEPTIDES AS INHIBITORS OF THE ICE/ced-3 FAMILY OF CYSTEINE PROTEASES | Idun Pharmaceuticals, Inc. (US) | 2001-04-18 | — | — | EP | claimed |
| WO-2000001666-A1 | C-TERMINAL MODIFIED OXAMYL DIPEPTIDES AS INHIBITORS OF THE ICE/ced-3 FAMILY OF CYSTEINE PROTEASES | IDUN PHARMACEUTICALS, INC. (US) | 2000-01-13 | — | — | WO | claimed |