Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 3/20 | 0.40 |
| ▸ | MMP1 | P03956 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | TOP1 | P11387 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL28653227 | 1.00 | MMP13 (0.40) | MMP13MMP1SLC6A3CYP19A1TDP1 | |
| SCHEMBL28658157 | 0.93 | MMP13 (0.46) | MMP13MMP1CYP19A1TDP1MMP2 | |
| SCHEMBL29188689 | 0.93 | MMP13 (0.46) | MMP13MMP1CYP19A1TDP1MMP2 | |
| SCHEMBL11663631 | 0.91 | DDB1 (0.43) | SLC6A3DDB1CRBNSLC6A2SLC18A3 | |
| SCHEMBL28648500 | 0.87 | SLC6A3 (0.45) | MMP13MMP1SLC6A3TDP1MMP2 | |
| SCHEMBL28648497 | 0.87 | SLC6A3 (0.45) | MMP13MMP1SLC6A3TDP1MMP2 | |
| SCHEMBL28657641 | 0.84 | HTR2C (0.41) | MMP13MMP1SLC6A3TDP1SLC6A2 | |
| SCHEMBL28661893 | 0.83 | ADRB2 (0.41) | MMP13MMP1TDP1MMP2MMP3 | |
| SCHEMBL28658169 | 0.83 | NAAA (0.40) | MMP13MMP1TDP1MMP2MMP3 | |
| SCHEMBL28658170 | 0.83 | NAAA (0.40) | MMP13MMP1TDP1MMP2MMP3 |
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 |