Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 8/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL798373 | 0.84 | TAAR1 (0.51) | ALDH1A1MEN1KMT2A | |
| SCHEMBL1787452 | 0.75 | CYP3A4 (0.54) | CYP3A4LMNAACHEPARP1MAOB | |
| SCHEMBL9544466 | 0.75 | CYP1A2 (0.47) | LMNAALDH1A1MAOBMEN1KMT2A | |
| SCHEMBL8765867 | 0.75 | CYP1A2 (0.47) | LMNAALDH1A1MAOBMEN1KMT2A | |
| SCHEMBL9356423 | 0.75 | CPA1 (0.44) | MAOANPC1 | |
| SCHEMBL694663 | 0.74 | TAAR1 (0.63) | CYP3A4LMNAACHEPARP1MAOA | |
| SCHEMBL694664 | 0.74 | TAAR1 (0.63) | CYP3A4LMNAACHEPARP1MAOA | |
| SCHEMBL21225979 | 0.73 | ALOX5 (0.57) | ALOX5CYP3A4LMNAACHEPARP1 | |
| SCHEMBL3243973 | 0.73 | ALOX5 (0.51) | ALOX5CYP3A4LMNAACHEPARP1 | |
| SCHEMBL3339215 | 0.73 | CYP3A4 (0.59) | ALOX5CYP3A4LMNAACHEPARP1 |
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-2091928-A2 | 3-(2-ACYLAMINO-1-HYDROXYETHYL)- MORPHOLINE DERIVATIVES AND THEIR USE AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2009-08-26 | — | — | EP | disclosed |
| WO-2006034093-A2 | 3- (2-ACYLAMINO-1-HYDROXYETHYL)- MORPHOLINE DERIVATIVES AND THEIR USE AS BACE INHIBITORS | ELLI LILLY AND COMPANY (US) | 2006-03-30 | — | — | WO | disclosed |