Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.72 |
| ▸ | LMNA | P02545 | 3/20 | 0.72 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.72 |
| ▸ | MAPT | P10636 | 3/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL30585248 | 0.90 | ALDH1A1 (0.61) | ALDH1A1LMNASMN1; SMN2MAPTKMT2A | |
| SCHEMBL29078385 | 0.88 | L3MBTL1 (0.67) | ALDH1A1LMNASMN1; SMN2MAPTKMT2A | |
| SCHEMBL29078403 | 0.84 | SMN1; SMN2 (1.00) | ALDH1A1LMNASMN1; SMN2MAPTKMT2A | |
| SCHEMBL29078401 | 0.81 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2POLBMDM2HSD17B10 | |
| SCHEMBL31232772 | 0.81 | MAPT (0.57) | ALDH1A1LMNASMN1; SMN2MAPTKMT2A | |
| SCHEMBL29078428 | 0.81 | CYP1A2 (0.57) | ALDH1A1LMNASMN1; SMN2MAPTKMT2A | |
| SCHEMBL30585257 | 0.81 | CYP1A2 (0.57) | ALDH1A1LMNASMN1; SMN2MAPTKMT2A | |
| SCHEMBL30585250 | 0.80 | LMNA (0.54) | ALDH1A1LMNASMN1; SMN2MAPTKMT2A | |
| SCHEMBL1646553 | 0.79 | MAPT (0.59) | ALDH1A1LMNASMN1; SMN2MAPTPOLB | |
| SCHEMBL31232871 | 0.78 | LMNA (0.54) | ALDH1A1LMNASMN1; SMN2MAPTKMT2A |
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-116803981-A | Piperazine-containing amide or sulfonamide anti-inflammatory compound and preparation method and application thereof | 温州医科大学 | 2023-09-26 | — | — | CN | claimed |
| CN-116803981-A | Piperazine-containing amide or sulfonamide anti-inflammatory compound and preparation method and application thereof | 温州医科大学 | 2023-09-26 | — | — | CN | disclosed |