Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6982084 | 0.85 | ALDH1A1 (0.48) | POLBGAAHTTALDH1A1LMNA | |
| SCHEMBL6978716 | 0.82 | MEN1 (0.48) | ALDH1A1DRD3LMNASMN1; SMN2KMT2A | |
| Hydrochloric Acid SCHEMBL6981599 | 0.81 | HTR1A (0.41) | HTTALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL8579633 | 0.79 | DRD3 (0.40) | GAAHTTALDH1A1DRD3LMNA | |
| SCHEMBL6980780 | 0.78 | CACNA2D1 (0.43) | GAATSHR | |
| SCHEMBL6977655 | 0.78 | TSHR (0.47) | POLBALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL6974100 | 0.76 | NPC1 (0.48) | POLBHTTALDH1A1DRD3TSHR | |
| SCHEMBL6985365 | 0.75 | LMNA (0.42) | POLBALDH1A1LMNASMN1; SMN2MAPK1 | |
| SCHEMBL6983488 | 0.75 | DRD2 (0.41) | HTTALDH1A1DRD3LMNAKMT2A | |
| SCHEMBL6981092 | 0.75 | DRD3 (0.34) | GAADRD3LMNAKMT2AMEN1 |
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-0923575-B1 | CYCLIC ETHER COMPOUNDS AS SODIUM CHANNEL MODULATORS | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-03-12 | — | — | EP | disclosed |
| US-6172085-B1 | CENTRAL NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-01-09 | — | — | US | disclosed |