Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.68 |
| ▸ | DRD3 | P35462 | 1/20 | 0.68 |
| ▸ | DRD4 | P21917 | 3/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 1/20 | 0.63 |
| ▸ | HPGD | P15428 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | HTR7 | P34969 | 2/20 | 0.59 |
| ▸ | HTR1A | P08908 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL27040086 | 0.91 | CYP2D6 (0.69) | DRD2DRD3DRD4ALDH1A1MEN1 | |
| SCHEMBL31593043 | 0.91 | CYP2D6 (0.69) | DRD2DRD3DRD4ALDH1A1MEN1 | |
| SCHEMBL6428902 | 0.90 | DRD2 (0.66) | DRD2DRD3DRD4ALDH1A1MEN1 | |
| SCHEMBL2323421 | 0.89 | DRD2 (0.64) | DRD2DRD3DRD4ALDH1A1MEN1 | |
| SCHEMBL7388920 | 0.85 | ALDH1A1 (0.65) | DRD2DRD3DRD4ALDH1A1MEN1 | |
| SCHEMBL32688379 | 0.85 | ALDH1A1 (0.80) | ALDH1A1MEN1KMT2AKDM4EGAA | |
| SCHEMBL17656753 | 0.84 | ITGB3 (0.63) | DRD2DRD3DRD4KDM4EHSD17B10 | |
| SCHEMBL1066467 | 0.84 | HTR2A (0.72) | DRD4ALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL6707329 | 0.83 | PRMT1 (0.67) | DRD2DRD3DRD4ALDH1A1MEN1 | |
| SCHEMBL2710557 | 0.82 | CYP2D6 (0.57) | DRD2DRD3ALDH1A1MEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1082308-B1 | HETEROCYCLICALLY SUBSTITUTED AMIDES USED AS CALPAIN INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2009-04-01 | — | — | EP | disclosed |
| US-6562827-B1 | For the treatment of diseases in which increased calpain activity occurs such as neurodegenerative diseases or neuronal damage are caused by ischemia, trauma or mass hemorrhages | ABBOTT LABORATORIES | 2003-05-13 | — | — | US | disclosed |
| EP-1082308-A1 | HETEROCYCLICALLY SUBSTITUTED AMIDES USED AS CALPAIN INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2001-03-14 | — | — | EP | disclosed |
| WO-1999054305-A1 | HETEROCYCLICALLY SUBSTITUTED AMIDES USED AS CALPAIN INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 1999-10-28 | — | — | WO | disclosed |