Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | MAP4K1 | Q92918 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 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 | |
|---|---|---|---|---|
| SCHEMBL15653224 | 0.80 | SMN1; SMN2 (0.47) | ALDH1A1HPGDL3MBTL1LMNASMN1; SMN2 | |
| SCHEMBL8549689 | 0.80 | LMNA (0.35) | ALDH1A1KMT2AMEN1L3MBTL1MAPT | |
| SCHEMBL8931160 | 0.80 | PIK3C3 (0.50) | PIK3C3ALDH1A1CNR1MAP4K1KMT2A | |
| SCHEMBL8828399 | 0.78 | PIK3C3 (0.49) | PIK3C3ALDH1A1CNR1MAP4K1KMT2A | |
| SCHEMBL15635234 | 0.77 | ALDH1A1 (0.42) | ALDH1A1KMT2AMEN1HPGDL3MBTL1 | |
| SCHEMBL15999462 | 0.77 | ALDH1A1 (0.56) | PIK3C3ALDH1A1CNR1MAP4K1KMT2A | |
| SCHEMBL8828590 | 0.77 | PIK3C3 (0.48) | PIK3C3ALDH1A1CNR1MAP4K1KMT2A | |
| SCHEMBL15390858 | 0.75 | CASP1 (0.46) | ALDH1A1KMT2AMEN1L3MBTL1HTT | |
| SCHEMBL8828527 | 0.73 | PIK3C3 (0.45) | PIK3C3ALDH1A1CNR1KMT2ALRRK2 | |
| SCHEMBL1553383 | 0.71 | ALDH1A1 (0.38) | PIK3C3ALDH1A1KMT2AMEN1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0702003-B1 | Process for preparing 2-halogenpyridinaldehydes | BAYER AG (DE) | 1998-06-17 | — | — | EP | disclosed |
| US-5708180-A | CYCLIZATION OF UNSATURATED NITRILE, AMIDE OR OXIME | BAYER AKTIENGESELLSCHAFT (DE) | 1998-01-13 | — | — | US | disclosed |
| EP-0702003-A2 | Process for preparing 2-halogenpyridinaldehydes and new 2-halogenpyridinaldehydes | BAYER AG (DE) | 1996-03-20 | — | — | EP | disclosed |