Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 7/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | PKM | P14618 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9788444 | 1.00 | ALDH1A1 (0.46) | ALDH1A1CYP3A4LMNAMAPTPKM | |
| SCHEMBL9788434 | 0.85 | ALDH1A1 (0.55) | ALDH1A1CYP3A4MAPTSMN1; SMN2HSP90AA1 | |
| SCHEMBL9788436 | 0.85 | ALDH1A1 (0.55) | ALDH1A1CYP3A4MAPTSMN1; SMN2HSP90AA1 | |
| SCHEMBL9854147 | 0.76 | CYP3A4 (0.44) | ALDH1A1CYP3A4LMNAMAPTPKM | |
| SCHEMBL9788441 | 0.74 | CYP3A4 (0.38) | ALDH1A1CYP3A4LMNAMAPTPKM | |
| SCHEMBL9788443 | 0.74 | CYP3A4 (0.35) | ALDH1A1CYP3A4LMNAHSP90AA1KMT2A | |
| SCHEMBL9788445 | 0.74 | CYP3A4 (0.35) | ALDH1A1CYP3A4LMNAHSP90AA1KMT2A | |
| SCHEMBL17030439 | 0.71 | CYP3A4 (0.53) | ALDH1A1CYP3A4LMNAMAPTPKM | |
| SCHEMBL1284639 | 0.71 | MAPT (0.58) | ALDH1A1LMNAMAPTPKMSMN1; SMN2 | |
| SCHEMBL1284638 | 0.71 | MAPT (0.58) | ALDH1A1LMNAMAPTPKMSMN1; SMN2 |
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-5041459-A | Plant diseases; protection of industrial materials | BAYER AKTIENGESELLSCHAFT (DE) | 1991-08-20 | — | — | US | claimed |