Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.40 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | PRNP | P04156 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| Ethyl Bromo Acetate SCHEMBL7509727 | 0.96 | ALDH1A1 (0.39) | ELANEALDH1A1NPSR1GPR55GAA | |
| SCHEMBL7512573 | 0.91 | ELANE (0.44) | ELANEALDH1A1NPSR1GPR55GAA | |
| SCHEMBL7507444 | 0.87 | ELANE (0.45) | ELANEALDH1A1NPSR1GPR55GAA | |
| SCHEMBL6992847 | 0.85 | ELANE (0.43) | ELANEALDH1A1NPSR1GPR55GAA | |
| SCHEMBL6993400 | 0.85 | ELANE (0.42) | ELANEALDH1A1GAAMAPTCYP2C19 | |
| SCHEMBL6986488 | 0.80 | GAA (0.36) | ELANEALDH1A1NPSR1GAAMAPT | |
| SCHEMBL6993226 | 0.80 | ELANE (0.41) | ELANEALDH1A1MAPTCYP2C19PKM | |
| SCHEMBL7513280 | 0.80 | ELANE (0.44) | ELANEALDH1A1GAAMAPTCYP2C19 | |
| SCHEMBL6993818 | 0.79 | ELANE (0.43) | ELANEALDH1A1NPSR1GPR55GAA | |
| SCHEMBL6987940 | 0.78 | ELANE (0.48) | ELANEALDH1A1NPSR1GPR55GAA |
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-1345918-A1 | CHEMICAL COMPOUNDS | AstraZeneca AB (SE) | 2003-09-24 | — | — | EP | disclosed |
| WO-2002050051-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2002-06-27 | — | — | WO | disclosed |