Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 3/20 | 0.69 |
| ▸ | ACHE | P22303 | 3/20 | 0.69 |
| ▸ | BACE1 | P56817 | 3/20 | 0.69 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.58 |
| ▸ | DRD4 | P21917 | 1/20 | 0.58 |
| ▸ | DRD2 | P14416 | 1/20 | 0.57 |
| ▸ | DRD3 | P35462 | 1/20 | 0.57 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | MPO | P05164 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | HBB | P68871 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL12433148 | 0.84 | DRD4 (0.55) | BCHEACHEBACE1SIGMAR1DRD4 | |
| SCHEMBL9785819 | 0.83 | ALDH1A1 (0.57) | BCHEACHEBACE1LMNAALDH1A1 | |
| SCHEMBL21658466 | 0.83 | MPO (0.81) | BCHEACHEBACE1SIGMAR1DRD4 | |
| Hydrochloric Acid SCHEMBL9785760 | 0.82 | ALDH1A1 (0.56) | BCHEACHEBACE1LMNAALDH1A1 | |
| SCHEMBL9720752 | 0.81 | DRD4 (0.77) | ACHEBACE1SIGMAR1DRD4DRD2 | |
| SCHEMBL2313324 | 0.80 | GFER (0.50) | BCHEACHEBACE1DRD2ALOX5 | |
| SCHEMBL2310308 | 0.78 | SIGMAR1 (0.69) | SIGMAR1DRD4DRD2DRD3LMNA | |
| SCHEMBL2311369 | 0.77 | TYR (0.47) | BCHEACHEBACE1SIGMAR1LMNA | |
| SCHEMBL10398153 | 0.77 | CYP2C9 (0.66) | BCHEACHEBACE1LMNAALDH1A1 | |
| SCHEMBL2489199 | 0.76 | SIGMAR1 (1.00) | ACHESIGMAR1DRD4LMNA |
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-1893207-B1 | USE OF SUBSTITUTED PIPERAZINE DERIVATIVES AND MORPHOLINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2011-08-03 | — | — | EP | disclosed |
| EP-1893207-B1 | USE OF SUBSTITUTED PIPERAZINE DERIVATIVES AND MORPHOLINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2011-08-03 | — | — | EP | disclosed |
| EP-1893207-A1 | USE OF SUBSTITUTED PIPERAZINE DERIVATIVES AND MORPHOLINE DERIVATIVES | Merck Patent GmbH (DE) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006133784-A1 | USE OF SUBSTITUTED PIPERAZINE DERIVATIVES AND MORPHOLINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2006-12-21 | — | — | WO | disclosed |