Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 4/20 | 0.58 |
| ▸ | PPARG | P37231 | 2/20 | 0.58 |
| ▸ | IDO1 | P14902 | 2/20 | 0.53 |
| ▸ | TDO2 | P48775 | 1/20 | 0.53 |
| ▸ | SLC17A5 | Q9NRA2 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | CTSL | P07711 | 2/20 | 0.45 |
| ▸ | CTSB | P07858 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19888241 | 0.88 | SLC17A5 (0.58) | SLC17A5MDM4TP53 | |
| SCHEMBL8139788 | 0.85 | CASP1 (0.48) | PPARAPPARGSLC17A5CASP1MDM4 | |
| SCHEMBL6989365 | 0.85 | CASP1 (0.48) | PPARAPPARGSLC17A5CASP1MDM4 | |
| SCHEMBL2399667 | 0.84 | SLC17A5 (0.47) | PPARAPPARGIDO1TDO2SLC17A5 | |
| SCHEMBL12707588 | 0.84 | SLC17A5 (0.47) | PPARAPPARGIDO1TDO2SLC17A5 | |
| SCHEMBL17446645 | 0.84 | HDAC1 (0.57) | PPARAPPARGIDO1TDO2SLC17A5 | |
| SCHEMBL23927277 | 0.84 | PPARA (0.73) | PPARAPPARGIDO1TDO2HDAC1 | |
| SCHEMBL13716720 | 0.82 | SLC17A5 (0.53) | PPARAPPARGIDO1TDO2SLC17A5 | |
| SCHEMBL12065748 | 0.82 | PPARA (0.60) | PPARAPPARGIDO1SLC17A5 | |
| SCHEMBL29908094 | 0.82 | SLC17A5 (0.61) | PPARAPPARGSLC17A5MDM4TP53 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7420051-B2 | Antitumor agents; microbiocides; antibiotics; forming a 1,4 bridge using a 1-labile, 10-hydroxy, 18-protected hydroxyl, di-6,8-en-5-one fused ring compound. After formation of the 1,4 brige, C-18 protection is removed before spiroamine introduction | PHARMA MAR, S.A. (ES) | 2008-09-02 | — | — | US | disclosed |