Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 5/20 | 0.60 |
| ▸ | CNR2 | P34972 | 5/20 | 0.60 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 4/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2015954 | 0.91 | CNR2 (0.62) | CNR1CNR2AKR1C3GABRA2GABRB2 | |
| SCHEMBL2016965 | 0.90 | CNR1 (0.59) | CNR1CNR2GABRA2GABRB2PDE5A | |
| SCHEMBL4607380 | 0.90 | CNR1 (0.61) | CNR1CNR2MEN1KMT2A | |
| SCHEMBL2018135 | 0.90 | CNR1 (0.61) | CNR1CNR2MEN1KMT2A | |
| SCHEMBL2288238 | 0.90 | CNR1 (0.61) | CNR1CNR2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL2020512 | 0.89 | CNR1 (0.58) | CNR1CNR2GABRA2GABRB2PDE5A | |
| SCHEMBL2018481 | 0.88 | CNR1 (0.73) | CNR1CNR2AKR1C3MEN1LMNA | |
| SCHEMBL2023028 | 0.87 | CNR1 (0.54) | CNR1CNR2MEN1LMNAHTT | |
| SCHEMBL2018944 | 0.86 | CNR1 (0.55) | CNR1CNR2MEN1LMNAMAPT | |
| SCHEMBL2020333 | 0.86 | CNR1 (0.55) | CNR1CNR2MEN1LMNAHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1910302-A1 | CARBONYL SUBSTITUTED PYRAZOLINE COMPOUNDS, THEIR PREPARATION AND USE AS CB1 RECEPTOR MODULATORS | Laboratorios del Dr. Esteve S.A. (ES) | 2008-04-16 | — | — | EP | claimed |
| WO-2007009687-A1 | CARBONYL SUBSTITUTED PYRAZOLINE COMPOUNDS, THEIR PREPARATION AND USE AS CB1 RECEPTOR MODULATORS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2007-01-25 | — | — | WO | claimed |