Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 6/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.43 |
| ▸ | TLR4 | O00206 | 1/20 | 0.43 |
| ▸ | TLR2 | O60603 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL561090 | 0.80 | MAOB (0.56) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL5024079 | 0.79 | BACE1 (0.46) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL28147393 | 0.79 | BACE1 (0.44) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL28171182 | 0.78 | MEN1 (0.47) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL28769206 | 0.78 | CYP1A2 (0.49) | MAOBMAPTMEN1KMT2ARAB9A | |
| SCHEMBL27647870 | 0.77 | MAPT (0.45) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL30832846 | 0.77 | MEN1 (0.57) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL1663438 | 0.77 | MEN1 (0.57) | BACE1MAOBMAPTMEN1KMT2A | |
| SCHEMBL28641449 | 0.76 | ERN1 (0.60) | MAOB | |
| SCHEMBL1734030 | 0.76 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110215933-A | A kind of preparation method of respiratory medicine object Ao Dateluo intermediate | 马海红 | 2019-09-10 | — | — | CN | disclosed |
| CN-110215933-A | A kind of preparation method of respiratory medicine object Ao Dateluo intermediate | 马海红 | 2019-09-10 | — | — | CN | disclosed |
| CN-101039937-A | Heteroaryl compounds for use as betamimetics in the treatment of respiratory diseases | BOEHRINGER INGELHEIM INT (DE) | 2007-09-19 | — | — | CN | disclosed |