Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 1/20 | 0.65 |
| ▸ | PARP1 | P09874 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 3/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.49 |
| ▸ | RAF1 | P04049 | 1/20 | 0.48 |
| ▸ | BRAF | P15056 | 1/20 | 0.48 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL861110 | 1.00 | MMP12 (0.65) | MMP12PARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL26604998 | 0.92 | MMP12 (0.56) | MMP12PARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL295559 | 0.86 | BRD4 (0.56) | MMP12PARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL29498119 | 0.85 | MMP12 (0.51) | MMP12PARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL13932129 | 0.83 | NR3C2 (0.62) | MMP12PARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4263588 | 0.83 | PARP1 (0.65) | MMP12PARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4258190 | 0.83 | NR3C2 (0.62) | MMP12PARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL1970405 | 0.80 | PKM (0.59) | MMP12PARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL29893671 | 0.80 | PKM (0.59) | MMP12PARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4263455 | 0.80 | PARP1 (0.60) | MMP12PARP1ALDH1A1MAPTPKM |
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-114436955-B | Tetrahydroquinoline and benzomorpholine derivatives or salts thereof, and preparation method and application thereof | 复旦大学 | 2024-08-09 | — | — | CN | disclosed |
| CN-114436955-A | Tetrahydroquinoline and benzomorpholine derivatives or salts thereof, and preparation method and application thereof | 复旦大学 | 2022-05-06 | — | — | CN | disclosed |