Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.45 |
| ▸ | ECE1 | P42892 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8590752 | 0.89 | TSHR (0.45) | CYP1A2CYP2D6CHRNA7CYP3A4ALDH1A1 | |
| SCHEMBL8591111 | 0.89 | GAA (0.47) | CYP1A2CYP2D6CHRNA7CYP2A6CYP3A4 | |
| SCHEMBL8589194 | 0.85 | GAA (0.48) | CYP3A4CYP2C9CYP2C19ALDH1A1NPSR1 | |
| SCHEMBL8587396 | 0.85 | FFAR2 (0.45) | CYP1A2CYP2D6CHRNA7CYP3A4CYP2C19 | |
| SCHEMBL8589515 | 0.85 | CYP2D6 (0.46) | CYP1A2CYP2D6CHRNA7CYP2A6CYP3A4 | |
| SCHEMBL8587389 | 0.85 | ALDH1A1 (0.43) | CYP1A2CYP2D6CHRNA7CYP2A6CYP3A4 | |
| SCHEMBL8586519 | 0.84 | LMNA (0.47) | CYP1A2CYP2D6CYP3A4ALDH1A1LMNA | |
| SCHEMBL8589108 | 0.84 | CHRNA7 (0.42) | LTA4HCYP1A2CYP2D6CHRNA7CYP2A6 | |
| SCHEMBL21835602 | 0.84 | SIGMAR1 (0.55) | CYP3A4 | |
| SCHEMBL170305 | 0.84 | SIGMAR1 (0.55) | CYP3A4 |
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 |