Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 2/20 | 0.32 |
| ▸ | CASP7 | P55210 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2610718 | 0.79 | ADORA2B (0.33) | ALDH1A1CYP1A2CYP3A4BRD4HSD17B10 | |
| SCHEMBL2116829 | 0.79 | ADORA2B (0.33) | ALDH1A1CYP1A2CYP3A4BRD4HSD17B10 | |
| SCHEMBL15177937 | 0.76 | ADORA2B (0.31) | ADORA2B | |
| SCHEMBL9733254 | 0.63 | ADORA2B (0.33) | ALDH1A1CYP1A2CYP3A4HSD17B10CYP2C9 | |
| SCHEMBL13383886 | 0.61 | ADORA2B (0.40) | ALDH1A1CYP3A4HSD17B10ADORA2BKDM4E | |
| SCHEMBL214654 | 0.59 | ADORA2B (0.36) | ALDH1A1ADORA2B | |
| SCHEMBL12861937 | 0.58 | KDM4E (0.32) | BRD4HSD17B10KDM4EKMT2A | |
| SCHEMBL3522549 | 0.57 | ALDH1A1 (0.42) | ALDH1A1CYP1A2CYP3A4BRD4HSD17B10 | |
| SCHEMBL14112924 | 0.55 | KDM4E (0.32) | HSD17B10KDM4E | |
| SCHEMBL19094969 | 0.55 | ADORA2B (0.47) | ALDH1A1CYP1A2CYP3A4CYP2C19ADORA2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-2626350-B1 | CYCLOPROPANE COMPOUND | EISAI R&D MAN CO LTD (JP) | 2015-04-15 | — | — | EP | disclosed |