Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.34 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.34 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL28790649 | 1.00 | AKR1C4 (0.38) | AKR1C4AKR1C3AKR1C2BRD4PTGER2 | |
| SCHEMBL4399644 | 1.00 | AKR1C4 (0.38) | AKR1C4AKR1C3AKR1C2BRD4PTGER2 | |
| SCHEMBL4399647 | 1.00 | AKR1C4 (0.38) | AKR1C4AKR1C3AKR1C2BRD4PTGER2 | |
| SCHEMBL20303552 | 0.84 | AKR1C4 (0.54) | AKR1C4AKR1C3AKR1C2PTGER2PTGER4 | |
| SCHEMBL5598068 | 0.84 | AKR1C4 (0.54) | AKR1C4AKR1C3AKR1C2PTGER2PTGER4 | |
| SCHEMBL11840607 | 0.84 | AKR1C4 (0.40) | AKR1C4AKR1C3AKR1C2MAPTTP53 | |
| SCHEMBL5598064 | 0.84 | AKR1C4 (0.54) | AKR1C4AKR1C3AKR1C2PTGER2PTGER4 | |
| SCHEMBL5383512 | 0.84 | AKR1C4 (0.54) | AKR1C4AKR1C3AKR1C2PTGER2PTGER4 | |
| SCHEMBL11756935 | 0.81 | AKR1C4 (0.58) | AKR1C4AKR1C3AKR1C2BRD4PTGER2 | |
| SCHEMBL11756928 | 0.81 | AKR1C4 (0.58) | AKR1C4AKR1C3AKR1C2BRD4PTGER2 |
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-1146033-B1 | Fragrance precursors | GIVAUDAN SA (CH) | 2009-12-23 | — | — | EP | disclosed |
| EP-1146033-A2 | Fragrance precursors | Givaudan SA (CH) | 2001-10-17 | — | — | EP | disclosed |