Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB1 | P20618 | 1/20 | 0.45 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 13/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5599425 | 0.77 | PSMB1 (0.43) | PSMB1PSMB5PSMB2LTA4HHRH3 | |
| SCHEMBL5599288 | 0.73 | PSMB1 (0.36) | PSMB1PSMB5PSMB2LTA4HHRH3 | |
| SCHEMBL5611378 | 0.70 | LTA4H (0.34) | PSMB1PSMB5PSMB2LTA4HHRH3 | |
| SCHEMBL25680303 | 0.68 | KCNH2 (0.56) | LTA4H | |
| SCHEMBL30628842 | 0.67 | KCNH2 (0.43) | — | |
| SCHEMBL16877094 | 0.64 | CALM1 (0.48) | LTA4H | |
| SCHEMBL25902251 | 0.63 | TDP1 (0.49) | — | |
| SCHEMBL7134872 | 0.62 | LTA4H (1.00) | PSMB1PSMB5PSMB2LTA4HHRH3 | |
| SCHEMBL9527901 | 0.61 | HRH3 (0.74) | PSMB1PSMB5PSMB2LTA4HHRH3 | |
| SCHEMBL7139563 | 0.61 | LTA4H (1.00) | PSMB1PSMB5PSMB2LTA4HHRH3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1746986-A1 | ACTIVE SUBSTANCE COMBINATION COMPRISING A CARBINOL COMBINED TO AT LEAST AN NSAID | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2007-01-31 | — | — | EP | claimed |
| WO-2005097099-A1 | ACTIVE SUBSTANCE COMBINATION COMPRISING A CARBINOL COMBINED TO AT LEAST AN NSAID | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2005-10-20 | — | — | WO | 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 |