Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.49 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28421726 | 0.88 | ALDH1A1 (0.57) | KMT2AHSD17B10MEN1ALDH1A1L3MBTL1 | |
| SCHEMBL28417419 | 0.87 | MAPT (0.54) | KMT2ATSHRPOLBMEN1ALDH1A1 | |
| SCHEMBL21644606 | 0.87 | TSHR (0.53) | KMT2ATSHRHSD17B10POLBMEN1 | |
| SCHEMBL30779553 | 0.87 | TSHR (0.53) | KMT2ATSHRHSD17B10POLBMEN1 | |
| SCHEMBL28412349 | 0.86 | HSD17B10 (0.55) | KMT2AHSD17B10POLBMEN1ALDH1A1 | |
| SCHEMBL28419066 | 0.80 | LRRK2 (0.51) | KMT2AMEN1LMNACYP3A4LRRK2 | |
| SCHEMBL28415323 | 0.80 | NPC1 (0.54) | KMT2AMEN1L3MBTL1LRRK2KDM4E | |
| SCHEMBL16860713 | 0.78 | HSD17B10 (0.58) | KMT2ATSHRHSD17B10MEN1ALDH1A1 | |
| SCHEMBL28412479 | 0.77 | LRRK2 (0.53) | L3MBTL1LRRK2 | |
| SCHEMBL28890981 | 0.77 | LRRK2 (0.51) | KMT2AL3MBTL1LRRK2 |
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-111164074-B | Heat shock protein 90 inhibitors | 台北医学大学 | 2024-02-02 | — | — | CN | disclosed |
| CN-111164074-A | Heat shock protein 90 inhibitor | 台北医学大学 | 2020-05-15 | — | — | CN | disclosed |