Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR8 | P51685 | 4/20 | 0.49 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 3/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 0.46 |
| ▸ | CCR3 | P51677 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5662139 | 0.83 | CYP2D6 (0.50) | CCR8CHRM4CYP2D6CYP2C9HIF1A | |
| SCHEMBL3032151 | 0.77 | CYP2D6 (0.67) | CYP2D6CYP2C9HIF1ALTA4HHRH3 | |
| SCHEMBL5313875 | 0.76 | MEN1 (0.54) | CCR8CYP2D6CYP2C9HIF1ALTA4H | |
| SCHEMBL5312528 | 0.75 | CYP2D6 (0.47) | CCR8CYP2D6CYP2C9HIF1ALTA4H | |
| SCHEMBL5663496 | 0.74 | LTA4H (0.60) | CHRM4LTA4HHRH3 | |
| SCHEMBL4924772 | 0.72 | ACKR3 (0.53) | CHRM4CCR3CHRM3 | |
| SCHEMBL4923562 | 0.72 | TSHR (0.54) | CCR3CHRM3 | |
| Hydrochloric Acid SCHEMBL1449142 | 0.70 | LTA4H (0.72) | CCR8LTA4H | |
| SCHEMBL5312991 | 0.70 | LTA4H (0.80) | CYP2D6CYP2C9HIF1ALTA4H | |
| SCHEMBL5331196 | 0.70 | LTA4H (0.82) | CCR8CHRM4LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007079003-A2 | AMIDE INHIBITORS OF LEUKOTRIENE A4 HYDROLASE | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2007-07-12 | — | — | WO | disclosed |