Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5117829 | 0.89 | CACNA1B (0.47) | CACNA1BEPHX2L3MBTL1ALDH1A1LMNA | |
| SCHEMBL5113474 | 0.83 | CACNA1B (0.50) | CACNA1BEPHX2L3MBTL1ALDH1A1GAA | |
| SCHEMBL5118112 | 0.78 | CACNA1B (0.51) | CACNA1BL3MBTL1LMNASMN1; SMN2DRD3 | |
| SCHEMBL5117010 | 0.78 | EPHX2 (0.45) | EPHX2L3MBTL1ALDH1A1LMNAKMT2A | |
| SCHEMBL7768817 | 0.77 | CACNA1B (0.57) | CACNA1BL3MBTL1ALDH1A1LMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4845373 | 0.76 | CACNA1B (0.56) | CACNA1BL3MBTL1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL5114271 | 0.76 | EPHX2 (0.46) | EPHX2L3MBTL1ALDH1A1LMNAKMT2A | |
| SCHEMBL6397109 | 0.75 | CACNA1B (0.58) | CACNA1BL3MBTL1ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL5110983 | 0.75 | CACNA1B (0.69) | CACNA1BL3MBTL1ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL5117571 | 0.75 | CACNA1B (0.57) | CACNA1BL3MBTL1ALDH1A1SMN1; SMN2TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6605608-B1 | Such as n-(1-benzylpiperidin-4-yl)-3-cyclohexylmethylthio-2-((4R)-3-t -butoxycarbonylthiazolidin-4-ylcarbonylamino)propan-a mide; n-type calcium channel inhibitors | ONO PHARMACEUTICAL CO., LTD (JP) | 2003-08-12 | — | — | US | claimed |