Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 3/20 | 0.46 |
| ▸ | MMP1 | P03956 | 2/20 | 0.46 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29188689 | 1.00 | MMP13 (0.46) | MMP13MMP1NAAABRD4NPC1 | |
| SCHEMBL28653229 | 0.93 | MMP13 (0.40) | MMP13MMP1NPC1RAB9ACYP19A1 | |
| SCHEMBL28653227 | 0.93 | MMP13 (0.40) | MMP13MMP1NPC1RAB9ACYP19A1 | |
| SCHEMBL11663631 | 0.83 | DDB1 (0.43) | — | |
| SCHEMBL28648497 | 0.83 | SLC6A3 (0.45) | MMP13MMP1MMP2MMP3MMP9 | |
| SCHEMBL28648500 | 0.83 | SLC6A3 (0.45) | MMP13MMP1MMP2MMP3MMP9 | |
| SCHEMBL28658169 | 0.80 | NAAA (0.40) | MMP13MMP1NAAANPC1RAB9A | |
| SCHEMBL28645234 | 0.80 | FPR1 (0.48) | MMP13MMP1MMP2MMP3MMP9 | |
| SCHEMBL30823802 | 0.80 | MMP13 (0.37) | MMP13MMP1MMP2MMP3MMP9 | |
| SCHEMBL28661893 | 0.80 | ADRB2 (0.41) | MMP13MMP1NAAAMMP2MMP3 |
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-113461599-B | Process for preparing piperidone compounds | 南方科技大学 | 2024-02-09 | — | — | CN | disclosed |
| CN-113461599-A | Process for producing piperidone compound | 南方科技大学 | 2021-10-01 | — | — | CN | disclosed |