Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 3/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | F2RL3 | Q96RI0 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAT2A | P31153 | 1/20 | 0.36 |
| ▸ | OXTR | P30559 | 1/20 | 0.35 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.35 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.35 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 2/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6509849 | 0.86 | CNR1 (0.51) | CNR1AVPR1AADORA2AADORA2BADORA1 | |
| SCHEMBL6510167 | 0.82 | CNR1 (0.36) | PIK3CACNR1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6510956 | 0.81 | CNR1 (0.42) | CNR1AVPR1AADORA2AADORA2BADORA1 | |
| SCHEMBL6510280 | 0.80 | CNR1 (0.38) | CNR1MAT2APTGESPDE2APDE10A | |
| SCHEMBL6508430 | 0.79 | CNR1 (0.44) | CNR1AVPR1AADORA2AADORA2BADORA1 | |
| SCHEMBL6514331 | 0.78 | CNR1 (0.42) | CNR1AVPR1AADORA2AADORA2BADORA1 | |
| SCHEMBL6506306 | 0.78 | CNR1 (0.39) | CNR1MAT2AAVPR1AADORA2AADORA2B | |
| SCHEMBL6517585 | 0.78 | CNR1 (0.43) | CNR1CYP1A2CYP3A4AVPR1A | |
| SCHEMBL6509280 | 0.75 | CNR1 (0.39) | CNR1AVPR1A | |
| SCHEMBL6509276 | 0.75 | CNR1 (0.39) | CNR1AVPR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005049615-A1 | PYRAZOLO`1,5-A!`1,3,5! TRIAZIN -4-ONE DERIVATIVES AS CB1 RECEPTOR ANTAGONISTS | PFIZER PRODUCTS INC. (US) | 2005-06-02 | — | — | WO | claimed |
| WO-2005049615-A1 | PYRAZOLO`1,5-A!`1,3,5! TRIAZIN -4-ONE DERIVATIVES AS CB1 RECEPTOR ANTAGONISTS | PFIZER PRODUCTS INC. (US) | 2005-06-02 | — | — | WO | disclosed |