Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL254098 | 0.84 | ALDH1A1 (0.36) | ALDH1A1NPSR1KMT2A | |
| SCHEMBL253118 | 0.79 | ALDH1A1 (0.38) | ALDH1A1NPSR1KMT2A | |
| SCHEMBL253590 | 0.79 | ALDH1A1 (0.38) | ALDH1A1NPSR1KMT2A | |
| SCHEMBL252873 | 0.77 | ALDH1A1 (0.35) | ALDH1A1KMT2A | |
| SCHEMBL253457 | 0.71 | ALDH1A1 (0.31) | ALDH1A1NPSR1 | |
| SCHEMBL435798 | 0.70 | — | — | |
| SCHEMBL8769520 | 0.70 | — | — | |
| SCHEMBL22200242 | 0.68 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL22200246 | 0.68 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL22200245 | 0.68 | ALDH1A1 (0.32) | ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6087520-A | Preparation of 1,3-bis(3-aminopropyl)tetramethyldisiloxane | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2000-07-11 | — | — | US | disclosed |