Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | METAP2 | P50579 | 1/20 | 0.40 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.40 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8055459 | 0.82 | KDM4E (0.42) | KDM4EALDH1A1HPGDMAPTTSHR | |
| SCHEMBL6228527 | 0.76 | KDM4E (0.47) | KDM4EALDH1A1HPGDMAPTTSHR | |
| SCHEMBL1743540 | 0.73 | BCAT2 (0.44) | KDM4EALDH1A1HPGDMAPTTSHR | |
| SCHEMBL8042279 | 0.72 | MAPT (0.42) | KDM4EALDH1A1HPGDMAPTTSHR | |
| SCHEMBL8055106 | 0.71 | ALDH1A1 (0.42) | KDM4EALDH1A1HPGDMAPTTSHR | |
| SCHEMBL8054028 | 0.71 | IRAK4 (0.46) | KDM4EALDH1A1HPGDMAPTTSHR | |
| SCHEMBL11524577 | 0.71 | ALDH1A1 (0.38) | KDM4EALDH1A1HPGDMAPTTSHR | |
| SCHEMBL1001688 | 0.71 | ALOX15 (0.38) | ALDH1A1MAPTTSHRPDK2GAA | |
| SCHEMBL8057920 | 0.70 | CYP3A4 (0.47) | KDM4EALDH1A1HPGDMAPTTSHR | |
| SCHEMBL25087672 | 0.69 | TSHR (0.39) | ALDH1A1TSHRPDK2LMNA |
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-2010056999-A9 | ENANTIOMERICALLY ENRICHED ARYLOAZOL- 2 -YL CYANOETHYLAMINO PARACITICIDAL COMPOUNDS | MERIAL LIMITED (US) | 2018-06-07 | — | — | WO | disclosed |