Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KLK7 | P49862 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KIT | P10721 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL29131784 | 0.88 | ALDH1A1 (0.39) | ALDH1A1MAPTKMT2AMEN1KLK7 | |
| SCHEMBL30877347 | 0.85 | CYP3A4 (0.38) | ALDH1A1MAPTKMT2AMEN1KLK7 | |
| SCHEMBL30877425 | 0.81 | ALDH1A1 (0.44) | ALDH1A1MAPTKMT2AMEN1KLK7 | |
| SCHEMBL30877495 | 0.80 | RAPGEF4 (0.48) | ALDH1A1MAPTKMT2AMEN1KLK7 | |
| SCHEMBL29131776 | 0.78 | NPC1 (0.40) | ALDH1A1MAPTKMT2AMEN1KLK7 | |
| SCHEMBL29131767 | 0.78 | ALDH1A1 (0.40) | ALDH1A1KLK7BRD4L3MBTL1KIT | |
| SCHEMBL30877462 | 0.76 | ALDH1A1 (0.42) | ALDH1A1MAPTKLK7BRD4L3MBTL1 | |
| SCHEMBL30877397 | 0.75 | ALDH1A1 (0.40) | ALDH1A1MAPTKMT2AMEN1KLK7 | |
| SCHEMBL29131772 | 0.75 | TP53 (0.39) | ALDH1A1MAPTKMT2AMEN1KLK7 | |
| SCHEMBL28733308 | 0.73 | ALDH1A1 (0.47) | ALDH1A1MAPTKMT2AMEN1L3MBTL1 |
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-117964643-B | Pyrrole [2,3-b ] pyridine derivative and preparation method and application thereof | 苏州朗睿生物医药有限公司 | 2024-07-02 | — | — | CN | disclosed |
| CN-117964643-A | Pyrrole [2,3-b ] pyridine derivative and preparation method and application thereof | 苏州朗睿生物医药有限公司 | 2024-05-03 | — | — | CN | disclosed |