Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 2/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6472118 | 0.78 | AKR1C1 (0.38) | AKR1C1HDAC4SMN1; SMN2 | |
| SCHEMBL11307986 | 0.78 | AKR1C1 (0.46) | AKR1C1MEN1KMT2AHDAC4HSD11B1 | |
| SCHEMBL4991848 | 0.69 | TRPA1 (0.36) | AKR1C1 | |
| SCHEMBL3313096 | 0.69 | ALDH1A1 (0.38) | SMN1; SMN2RORCNR1I2 | |
| SCHEMBL28149790 | 0.68 | AKR1C1 (0.46) | AKR1C1MEN1KMT2AHDAC4 | |
| SCHEMBL28426673 | 0.68 | AKR1C1 (0.53) | AKR1C1MEN1KMT2AHDAC4HSD11B1 | |
| SCHEMBL42114 | 0.68 | AKR1C1 (0.70) | AKR1C1MEN1KMT2AHDAC4HSD11B1 | |
| SCHEMBL43810 | 0.66 | AKR1C1 (0.68) | AKR1C1MEN1KMT2AHDAC4HSD11B1 | |
| SCHEMBL3312805 | 0.66 | BACE1 (0.35) | MEN1KMT2ASMN1; SMN2RORCNR1I2 | |
| SCHEMBL518236 | 0.66 | AKR1C1 (0.40) | AKR1C1HDAC4SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2214487-A1 | NOVEL SEH INHIBITORS AND THEIR USE | GlaxoSmithKline LLC (US) | 2010-08-11 | — | — | EP | disclosed |
| WO-2009049157-A1 | NOVEL SEH INHIBITORS AND THEIR USE | SMITHKLINE BEECHAM CORPORATION (US) | 2009-04-16 | — | — | WO | disclosed |