Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6451095 | 1.00 | LTA4H (0.43) | LTA4HCYP2D6CYP1A2HIF1ALMNA | |
| SCHEMBL5563536 | 1.00 | LTA4H (0.43) | LTA4HCYP2D6CYP1A2HIF1ALMNA | |
| SCHEMBL28217918 | 0.85 | LTA4H (0.47) | LTA4H | |
| SCHEMBL14364976 | 0.81 | LTA4H (0.42) | LTA4HCYP2D6GBA1 | |
| SCHEMBL20832991 | 0.79 | CYP2D6 (0.56) | CYP2D6CYP1A2HIF1ALMNAKDM4E | |
| SCHEMBL22259900 | 0.79 | CYP2D6 (0.56) | CYP2D6CYP1A2HIF1ALMNAKDM4E | |
| SCHEMBL8507267 | 0.79 | CYP2D6 (0.56) | CYP2D6CYP1A2HIF1ALMNAKDM4E | |
| SCHEMBL20833013 | 0.79 | CYP2D6 (0.56) | CYP2D6CYP1A2HIF1ALMNAKDM4E | |
| SCHEMBL18284812 | 0.79 | LTA4H (0.38) | LTA4HGBA1 | |
| SCHEMBL10679403 | 0.77 | CYP2D6 (0.62) | CYP2D6CYP1A2HIF1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1492794-A1 | PIPERAZINE SUBSTITUTED ARYL BENZODIAZEPINES AND THEIR USE AS DOPAMINE RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PSYCHOTIC DISORDERS | ELI LILLY AND COMPANY (US) | 2005-01-05 | — | — | EP | disclosed |
| WO-2003082877-A1 | PIPERAZINE SUBSTITUTED ARYL BENZODIAZEPINES AND THEIR USE AS DOPAMINE RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PSYCHOTIC DISORDERS | ELI LILLY AND COMPANY (US) | 2003-10-09 | — | — | WO | disclosed |