Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8091283 | 0.93 | SIGMAR1 (0.79) | SIGMAR1LMNACYP1A2CYP2D6CYP2C19 | |
| N-Benzylamphetamine SCHEMBL2451256 | 0.82 | SIGMAR1 (1.00) | SIGMAR1LMNACYP1A2CYP2D6MAPK1 | |
| N-Benzylamphetamine SCHEMBL2795222 | 0.82 | SIGMAR1 (1.00) | SIGMAR1LMNACYP1A2CYP2D6MAPK1 | |
| N-Benzylamphetamine SCHEMBL2798189 | 0.82 | SIGMAR1 (1.00) | SIGMAR1LMNACYP1A2CYP2D6MAPK1 | |
| N-Benzylamphetamine SCHEMBL8085021 | 0.81 | SIGMAR1 (0.96) | SIGMAR1LMNACYP1A2CYP2D6MAPK1 | |
| SCHEMBL8587928 | 0.80 | DPP7 (0.47) | SIGMAR1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL24997843 | 0.80 | SIGMAR1 (0.79) | SIGMAR1LMNACYP1A2CYP2D6MAPK1 | |
| SCHEMBL606189 | 0.80 | SIGMAR1 (0.85) | SIGMAR1LMNACYP1A2CYP2D6MAPK1 | |
| SCHEMBL12377261 | 0.79 | CYP1A2 (0.49) | LMNACYP1A2CYP2D6CYP2C19MAPK1 | |
| SCHEMBL608555 | 0.78 | SIGMAR1 (0.82) | SIGMAR1LMNACYP1A2CYP2D6MAPK1 |
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 |