Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 7/20 | 0.58 |
| ▸ | CNR2 | P34972 | 5/20 | 0.58 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | PRKCZ | Q05513 | 4/20 | 0.35 |
| ▸ | PDE5A | O76074 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4605995 | 0.94 | CNR1 (0.64) | CNR1CNR2NR3C2KIF11NOTUM | |
| SCHEMBL4606764 | 0.90 | CNR1 (0.57) | CNR1CNR2NR3C2EGFR | |
| SCHEMBL4607251 | 0.90 | CNR1 (0.57) | CNR1CNR2NR3C2KIF11PDE5A | |
| SCHEMBL2021231 | 0.89 | CNR1 (0.59) | CNR1CNR2NR3C2KIF11NOTUM | |
| SCHEMBL4607305 | 0.87 | CNR1 (0.54) | CNR1CNR2PDE5AEGFR | |
| SCHEMBL2016969 | 0.85 | CNR1 (0.57) | CNR1CNR2NR3C2KIF11EGFR | |
| SCHEMBL4606979 | 0.85 | CNR1 (0.53) | CNR1CNR2NR3C2KIF11NOTUM | |
| SCHEMBL8471091 | 0.84 | CNR1 (0.61) | CNR1CNR2 | |
| SCHEMBL5274265 | 0.84 | CNR1 (0.56) | CNR1CNR2 | |
| SCHEMBL8452076 | 0.84 | CNR1 (0.53) | CNR1CNR2NR3C2KIF11PRKCZ |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1946777-A1 | Substituted pyrazoline for preventing weight gain | Laboratorios del Dr. Esteve S.A. (ES) | 2008-07-23 | — | — | EP | claimed |
| EP-1946778-A1 | Active substance combination for the treatment of diabetes | Laboratorios del Dr. Esteve S.A. (ES) | 2008-07-23 | — | — | EP | claimed |
| EP-1743887-A1 | Thiocarbonyl-substituted pyrazoline compounds, their preparation and use as CB1 modulators | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2007-01-17 | — | — | EP | claimed |
| EP-1946777-A1 | Substituted pyrazoline for preventing weight gain | Laboratorios del Dr. Esteve S.A. (ES) | 2008-07-23 | — | — | EP | disclosed |
| EP-1946778-A1 | Active substance combination for the treatment of diabetes | Laboratorios del Dr. Esteve S.A. (ES) | 2008-07-23 | — | — | EP | disclosed |
| EP-1743887-A1 | Thiocarbonyl-substituted pyrazoline compounds, their preparation and use as CB1 modulators | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2007-01-17 | — | — | EP | disclosed |