Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | CASP7 | P55210 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10784057 | 0.91 | KDM4E (0.50) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL10786858 | 0.90 | ALDH1A1 (0.49) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL10786103 | 0.88 | ALDH1A1 (0.51) | ALDH1A1KDM4EMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL10781710 | 0.88 | NR3C2 (0.53) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL10781987 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL10782866 | 0.86 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL10783621 | 0.86 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL10912750 | 0.86 | ALDH1A1 (0.48) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL10787478 | 0.85 | MAPT (0.49) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD | |
| SCHEMBL9689463 | 0.84 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTSMN1; SMN2HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0110073-B1 | PROCESS FOR THE PREPARATION OF TETRAHYDROPYRIDINES | BAYER AG (DE) | 1987-07-01 | — | — | EP | disclosed |
| EP-0110073-A1 | Process for the preparation of tetrahydropyridines | BAYER AG (DE) | 1984-06-13 | — | — | EP | disclosed |