Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.55 |
| ▸ | CES1 | P23141 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | PGR | P06401 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 6/20 | 0.45 |
| ▸ | NPC1 | O15118 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL17454033 | 0.87 | SMN1; SMN2 (0.55) | HTTRAB9APPARGPPARASMN1; SMN2 | |
| SCHEMBL8801038 | 0.85 | CES2 (0.54) | CES2CES1LMNAHPGDALDH1A1 | |
| SCHEMBL981886 | 0.80 | CES2 (0.52) | CES2CES1HPGDRAB9ANPC1 | |
| SCHEMBL7485120 | 0.80 | CES2 (0.67) | CES2CES1LMNAALDH1A1CYP1A2 | |
| SCHEMBL7485126 | 0.77 | CES2 (0.67) | CES2CES1LMNAHPGDALDH1A1 | |
| SCHEMBL29972427 | 0.76 | CES2 (0.67) | CES2CES1LMNAALDH1A1HTT | |
| SCHEMBL8799866 | 0.76 | CES2 (0.51) | CES2CES1LMNAHPGDALDH1A1 | |
| SCHEMBL30520219 | 0.76 | CES2 (0.68) | CES2CES1HPGDALDH1A1HTT | |
| SCHEMBL10709497 | 0.76 | CES2 (0.68) | CES2CES1HPGDALDH1A1HTT | |
| SCHEMBL29263230 | 0.75 | HPGD (0.58) | LMNAHPGDALDH1A1HTTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0772601-A1 | 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1997-05-14 | — | — | EP | disclosed |