Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 7/20 | 0.68 |
| ▸ | ECE1 | P42892 | 1/20 | 0.59 |
| ▸ | MMP2 | P08253 | 1/20 | 0.56 |
| ▸ | MMP7 | P09237 | 1/20 | 0.56 |
| ▸ | MMP9 | P14780 | 1/20 | 0.56 |
| ▸ | MMP12 | P39900 | 1/20 | 0.56 |
| ▸ | MMP13 | P45452 | 1/20 | 0.56 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.55 |
| ▸ | MME | P08473 | 5/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | CPA1 | P15085 | 2/20 | 0.55 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL21246823 | 1.00 | ACE (0.68) | ACEECE1MMP2MMP7MMP9 | |
| SCHEMBL7373769 | 0.89 | ACE (0.74) | ACEECE1MMP2MMP7MMP9 | |
| SCHEMBL10030547 | 0.89 | ACE (0.74) | ACEECE1MMP2MMP7MMP9 | |
| SCHEMBL28531467 | 0.88 | ACE (0.64) | ACEMMECPA1ACE2NAALAD2 | |
| SCHEMBL21261748 | 0.88 | ACE (0.64) | ACEMMECPA1ACE2NAALAD2 | |
| SCHEMBL21481163 | 0.88 | FCER2 (0.58) | ACEPSMB5 | |
| D-Glutamate SCHEMBL28542987 | 0.86 | NAALAD2 (0.56) | ACEECE1MMP2MMP7MMP9 | |
| SCHEMBL21261590 | 0.85 | NAALAD2 (0.61) | ACEMMP2MMP7MMP9MMP12 | |
| SCHEMBL31236278 | 0.84 | TP53 (0.57) | ACEPSMB5 | |
| SCHEMBL10504767 | 0.83 | ITGB3 (0.65) | ACEECE1PSMB5MMEL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108017555-B | Beta-hydroxybutyryl-amino acid compound and preparation method and application thereof | 郑州海斯威生物技术有限公司 | 2021-03-26 | — | — | CN | disclosed |
| WO-2019104851-A4 | BETA-HYDROXYBUTYRYL-AMINO ACID COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 刘成 | 2019-08-15 | — | — | WO | disclosed |