Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 9/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 8/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | TOP1 | P11387 | 4/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGAV | P06756 | 1/20 | 0.32 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26762735 | 0.95 | HDAC3 (0.36) | HDAC1HDAC6HDAC3ELANETOP1 | |
| SCHEMBL22618831 | 0.95 | ELANE (0.38) | HDAC1HDAC6HDAC3ELANETOP1 | |
| SCHEMBL21137877 | 0.94 | HDAC1 (0.36) | HDAC1HDAC6HDAC3ELANETOP1 | |
| SCHEMBL26762430 | 0.91 | ELANE (0.38) | HDAC1HDAC6HDAC3ELANETOP1 | |
| SCHEMBL22561402 | 0.90 | ELANE (0.35) | HDAC1HDAC6HDAC3ELANEITGB3 | |
| SCHEMBL22561328 | 0.88 | ELANE (0.37) | HDAC1HDAC6HDAC3ELANETOP1 | |
| SCHEMBL21137580 | 0.87 | ELANE (0.38) | HDAC1HDAC6HDAC3ELANETOP1 | |
| SCHEMBL22618730 | 0.87 | ELANE (0.38) | HDAC1HDAC6HDAC3ELANETOP1 | |
| SCHEMBL29293293 | 0.87 | ELANE (0.38) | HDAC1HDAC6HDAC3ELANETOP1 | |
| SCHEMBL22618789 | 0.86 | ELANE (0.35) | HDAC1HDAC6HDAC3ELANETOP1 |
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-2019114666-A1 | BIOACTIVE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2019-06-20 | — | — | WO | disclosed |