Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.33 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.33 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5599107 | 0.74 | CHRNB4 (0.37) | LTA4HPSMB1PSMB5PSMB2 | |
| SCHEMBL5599288 | 0.73 | PSMB1 (0.36) | LTA4HPSMB1PSMB5PSMB2 | |
| SCHEMBL5599336 | 0.71 | PSMB1 (0.45) | LTA4HPSMB1PSMB5PSMB2 | |
| SCHEMBL5599117 | 0.71 | PSMB1 (0.34) | LTA4HPSMB1PSMB5PSMB2 | |
| SCHEMBL5611378 | 0.70 | LTA4H (0.34) | ALDH1A1LTA4HKMT2APSMB1PSMB5 | |
| SCHEMBL25680303 | 0.69 | KCNH2 (0.56) | GAALMNALTA4HPDE4DPDE4B | |
| SCHEMBL30628842 | 0.68 | KCNH2 (0.43) | GAAALDH1A1MEN1KMT2AHSD17B10 | |
| SCHEMBL16877094 | 0.66 | CALM1 (0.48) | GAALTA4HPDE4BGRM2 | |
| SCHEMBL5599372 | 0.65 | CYP1A2 (0.35) | LMNALTA4HMEN1KMT2A | |
| SCHEMBL15114294 | 0.63 | LMNA (0.57) | GAAALDH1A1KDM4ELMNALTA4H |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1103243-B1 | UTILIZATION OF ARYL(OR HETEROARYL)AZOLYLCARBINOL DERIVATIVES FOR THE TREATMENT OF TROUBLES MEDIATED BY AN EXCESS OF SUBSTANCE P | ESTEVE LABOR DR (ES) | 2004-01-07 | — | — | EP | claimed |
| EP-1755678-A2 | ACTIVE SUBSTANCE COMBINATION OF A CARBINOL COMPOUND AND AN OPIOID | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2007-02-28 | — | — | EP | disclosed |
| WO-2005097192-A2 | ACTIVE SUBSTANCE COMBINATION OF A CARBINOL COMPOUND AND AN OPIOID | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2005-10-20 | — | — | WO | disclosed |