Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR2 | O15552 | 1/20 | 0.45 |
| ▸ | VNN1 | O95497 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL8591111 | 0.86 | GAA (0.47) | CYP3A4CYP2C19ALDH1A1NPSR1CYP1A2 | |
| SCHEMBL8588407 | 0.85 | LTA4H (0.47) | CYP3A4CYP2C19ALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL8590752 | 0.83 | TSHR (0.45) | CYP3A4NAMPTALDH1A1NPSR1CYP1A2 | |
| SCHEMBL8588116 | 0.81 | CYP1A2 (0.42) | CYP3A4CYP2C19NAMPTALDH1A1CYP1A2 | |
| SCHEMBL8590761 | 0.80 | MEN1 (0.50) | VNN1CYP3A4NAMPTALDH1A1MAPT | |
| SCHEMBL8589194 | 0.80 | GAA (0.48) | CYP3A4CYP2C19NAMPTALDH1A1SMN1; SMN2 | |
| SCHEMBL8587389 | 0.80 | ALDH1A1 (0.43) | CYP3A4CYP2C19NAMPTALDH1A1MAPT | |
| SCHEMBL8589507 | 0.78 | KIF11 (0.49) | ALDH1A1SIGMAR1 | |
| SCHEMBL8587466 | 0.78 | KCNH2 (0.56) | FFAR2ALDH1A1 | |
| SCHEMBL8587669 | 0.78 | CYP2D6 (0.53) | CYP3A4NAMPTALDH1A1MAPTCYP1A2 |
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-1998052890-A1 | 3-ARYLPROPYLAMINO NEUROPEPTIDE Y RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1998-11-26 | — | — | WO | disclosed |