Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAD52 | P43351 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12576431 | 0.83 | POLB (0.50) | HSD11B1ALDH1A1GAATSHRRAB9A | |
| SCHEMBL6203754 | 0.79 | PHGDH (0.48) | HSD11B1ALDH1A1PKML3MBTL1SMN1; SMN2 | |
| SCHEMBL6319724 | 0.74 | HTR2A (0.46) | HSD11B1ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL1266219 | 0.73 | HSD11B1 (0.54) | HSD11B1ALDH1A1TSHRRAB9AHTT | |
| SCHEMBL13503653 | 0.72 | POLB (0.66) | HRH3 | |
| SCHEMBL6326000 | 0.71 | HRH3 (0.43) | HRH3ALDH1A1TRPV4GAAPKM | |
| SCHEMBL941270 | 0.71 | PARP10 (0.54) | HSD11B1RAB9A | |
| SCHEMBL13779326 | 0.70 | TSHR (0.69) | ALDH1A1TSHRRAB9ALMNAHTT | |
| SCHEMBL459166 | 0.69 | HSD11B1 (0.59) | HSD11B1ALDH1A1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL5907942 | 0.69 | HSD11B1 (0.51) | RAD52HSD11B1ALDH1A1GAARAB9A |
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-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |