Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10496800 | 1.00 | ACHE (0.41) | ACHEDRD2DRD4DRD3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10497280 | 0.99 | ALDH1A1 (0.40) | ACHEDRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL10496513 | 0.92 | ACHE (0.40) | ACHEDRD2DRD4DRD3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10496617 | 0.91 | ACHE (0.39) | ACHEDRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL10496849 | 0.87 | NCF1 (0.43) | ACHEDRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL10496515 | 0.87 | NCF1 (0.43) | ACHEDRD2DRD4DRD3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10496858 | 0.86 | NCF1 (0.42) | ACHEDRD2DRD4DRD3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10496525 | 0.86 | NCF1 (0.42) | ACHEDRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL10496666 | 0.86 | ACHE (0.42) | ACHEDRD2DRD4DRD3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10496902 | 0.85 | ACHE (0.41) | ACHEDRD2DRD4DRD3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4839353-A | Anti-ulcer substituted pyridine derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1989-06-13 | — | — | US | disclosed |
| EP-0264883-A2 | Substituted pyridine derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1988-04-27 | — | — | EP | disclosed |