Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.31 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL9510001 | 0.81 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1GAAALDH3A1ALDH1A3 | |
| SCHEMBL29566288 | 0.81 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1GAAALDH3A1ALDH1A3 | |
| SCHEMBL16758891 | 0.77 | ALDH1A3 (0.41) | SCN9AALDH1A1L3MBTL1ALDH3A1ALDH1A3 | |
| SCHEMBL18400155 | 0.76 | PTGS2 (0.36) | SCN9AL3MBTL1GAACYP2C9LMNA | |
| SCHEMBL14831752 | 0.75 | SMN1; SMN2 (0.39) | SCN9AALDH1A1L3MBTL1LMNASMN1; SMN2 | |
| SCHEMBL15599223 | 0.75 | SCN9A (0.40) | SCN9AGAAKMT2ACYP2C9LMNA | |
| SCHEMBL22322031 | 0.75 | SSTR4 (0.35) | ALDH1A1ALDH3A1ALDH1A3KMT2ANUDT1 | |
| SCHEMBL4536724 | 0.75 | DRD1 (0.39) | SCN9AALDH1A1L3MBTL1GAAALDH1A3 | |
| SCHEMBL16175217 | 0.74 | SCN9A (0.42) | SCN9AALDH1A1GAAMEN1KMT2A | |
| SCHEMBL16838841 | 0.72 | SCN9A (0.42) | SCN9AALDH1A1IP6K1HPGDSSTR4 |
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-0411364-B1 | PROCESS FOR THE PREPARATION OF CHLORINATED NICOTINE-ALDEHYDES | BAYER AG (DE) | 1993-10-06 | — | — | EP | disclosed |
| US-5051513-A | Preparation of chlorinated nicotinaldehydes | BAYER AKTIENGESELLSCHAFT (DE) | 1991-09-24 | — | — | US | disclosed |
| EP-0411364-A1 | Process for the preparation of chlorinated nicotine-aldehydes | BAYER AG (DE) | 1991-02-06 | — | — | EP | disclosed |