Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TLR4 | O00206 | 1/20 | 0.40 |
| ▸ | TLR2 | O60603 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27647870 | 0.85 | MAPT (0.45) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL28102855 | 0.81 | CYP1A2 (0.44) | MAOBMAPTMEN1KMT2ARAB9A | |
| SCHEMBL27684770 | 0.79 | BACE1 (0.52) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL5024079 | 0.78 | BACE1 (0.46) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL561090 | 0.76 | MAOB (0.56) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL28171182 | 0.74 | MEN1 (0.47) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL1663438 | 0.73 | MEN1 (0.57) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL30832846 | 0.73 | MEN1 (0.57) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL27563285 | 0.72 | MEN1 (0.48) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL1734030 | 0.72 | BACE1 (0.55) | BACE1MAOBMAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-106995414-A | The beta-agonists its preparation method and its purposes in medicament forms of new enantiomeric pure | 贝林格尔英格海姆法玛两合公司 | 2017-08-01 | — | — | CN | disclosed |