Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | STAT3 | P40763 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL13848086 | 0.89 | ALDH1A1 (0.69) | ALDH1A1GAAHSD17B10HTTLMNA | |
| SCHEMBL21644559 | 0.86 | GAA (0.64) | ALDH1A1GAAHSD17B10HTTLMNA | |
| SCHEMBL13848258 | 0.85 | PGAM1 (0.56) | ALDH1A1GAAHSD17B10HTTLMNA | |
| SCHEMBL13848247 | 0.83 | ALDH1A1 (0.65) | ALDH1A1GAAHSD17B10HTTLMNA | |
| SCHEMBL13848441 | 0.81 | STAT3 (0.57) | ALDH1A1LMNASTAT3USP2POLB | |
| SCHEMBL13848087 | 0.80 | L3MBTL1 (0.59) | ALDH1A1GAAHSD17B10HTTLMNA | |
| SCHEMBL13848260 | 0.78 | ALDH1A1 (0.47) | ALDH1A1GAAHSD17B10HTTLMNA | |
| SCHEMBL7574096 | 0.75 | MEN1 (0.71) | GAAHTTMAPTMEN1KMT2A | |
| SCHEMBL13848332 | 0.75 | PGAM1 (0.46) | ALDH1A1GAAHSD17B10HTTLMNA | |
| SCHEMBL13848265 | 0.75 | PARP14 (0.49) | ALDH1A1GAAHSD17B10HTTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |