Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MPI | P34949 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19971159 | 0.82 | ERN1 (0.33) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL20089295 | 0.80 | ALDH1A1 (0.39) | ALDH1A1TDP1MEN1KMT2AERN1 | |
| SCHEMBL22729409 | 0.77 | KDM4E (0.38) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL15434050 | 0.77 | CYP1A2 (0.38) | ALDH1A1MEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL31447380 | 0.77 | POLB (0.35) | ALDH1A1TDP1MEN1KMT2A | |
| SCHEMBL30082527 | 0.77 | KDM4E (0.38) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL20571174 | 0.74 | CYP1A2 (0.33) | ALDH1A1MEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL8548859 | 0.72 | PIK3CD (0.39) | ALDH1A1TDP1MEN1KMT2AERN1 | |
| SCHEMBL25288597 | 0.72 | NFE2L2 (0.37) | ALDH1A1TDP1MEN1KMT2AERN1 | |
| SCHEMBL20752986 | 0.72 | — | — |
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 |