Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | SLC6A7 | Q99884 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5251801 | 0.99 | RIPK1 (0.38) | RIPK1ACACBALDH1A1KDRSLC6A7 | |
| SCHEMBL5250616 | 0.95 | HRH2 (0.39) | RIPK1ACACBALDH1A1KDRSLC6A7 | |
| SCHEMBL5253147 | 0.92 | LMNA (0.41) | RIPK1ALDH1A1KDRSLC6A7HPGD | |
| Hydrochloric Acid SCHEMBL5307963 | 0.91 | LMNA (0.40) | RIPK1ALDH1A1KDRSLC6A7HPGD | |
| SCHEMBL5254333 | 0.88 | ALDH1A1 (0.44) | ALDH1A1KDRSLC6A7HPGDKDM4E | |
| Hydrochloric Acid SCHEMBL5252156 | 0.87 | ALDH1A1 (0.43) | ALDH1A1KDRSLC6A7HPGDKDM4E | |
| SCHEMBL5254634 | 0.83 | GBA1 (0.47) | ALDH1A1SLC6A7HPGDKDM4ELMNA | |
| SCHEMBL5251934 | 0.82 | KDM4E (0.44) | ACACBALDH1A1SLC6A7HPGDKDM4E | |
| Hydrochloric Acid SCHEMBL5255413 | 0.82 | GBA1 (0.46) | ALDH1A1SLC6A7HPGDKDM4ELMNA | |
| Hydrochloric Acid SCHEMBL5253011 | 0.81 | KDM4E (0.43) | ACACBALDH1A1SLC6A7HPGDKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1327630-B1 | NEW DERIVATIVES OF CYANO-ARYL (OR CYANOHETEROARYL)-CARBONYL-PIPERAZINYL-PYRIMIDINES, THEIR PREPARATION AND APPLICATION AS MEDICATION | ESTEVE LABOR DR (ES) | 2007-12-12 | — | — | EP | claimed |
| US-7300937-B2 | Derivatives of cyano-aryl (or cyanoheteroaryl)-carbonyl-piperazinyl-pyrimidines, their preparation and application as medication | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2007-11-27 | — | — | US | claimed |
| EP-1327630-A1 | NEW DERIVATIVES OF CYANO-ARYL (OR CYANOHETEROARYL)-CARBONYL-PIPERAZINYL-PYRIMIDINES, THEIR PREPARATION AND APPLICATION AS MEDICATION | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2003-07-16 | — | — | EP | claimed |