Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7277424 | 1.00 | ALOX5 (0.41) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7277420 | 1.00 | ALOX5 (0.41) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7268248 | 1.00 | ALOX5 (0.41) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7268251 | 1.00 | ALOX5 (0.41) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL8796242 | 0.80 | ALOX5 (0.47) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL13957844 | 0.80 | ALOX5 (0.47) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL19830553 | 0.78 | NPC1 (0.44) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL23655270 | 0.76 | ALOX5 (0.43) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL19757658 | 0.75 | ALOX5 (0.46) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL20604375 | 0.75 | ALOX5 (0.46) | ALOX5CYP3A4CYP2D6SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0376040-A2 | N-phosphinyl di-and tripeptides as renin inhibitors | AMERICAN CYANAMID COMPANY (US) | 1990-07-04 | — | — | EP | disclosed |