Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.46 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.46 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1707992 | 0.83 | CYSLTR1 (0.57) | CYSLTR1CYSLTR2PDE10ACYP1A2GPBAR1 | |
| SCHEMBL2913941 | 0.78 | PDE10A (0.61) | CYSLTR1CYSLTR2PDE10ACYP1A2CYP3A4 | |
| SCHEMBL8764374 | 0.77 | CYSLTR1 (0.46) | CYSLTR1CYSLTR2PDE10ACYP1A2GPBAR1 | |
| SCHEMBL10980763 | 0.75 | CYP1A2 (0.53) | CYSLTR1CYSLTR2PDE10ACYP1A2GPBAR1 | |
| Water SCHEMBL27574375 | 0.75 | CYSLTR1 (0.45) | CYSLTR1CYSLTR2PDE10ACYP1A2GPBAR1 | |
| SCHEMBL1262322 | 0.74 | PDE10A (0.50) | CYSLTR1CYSLTR2PDE10ACYP1A2GPBAR1 | |
| SCHEMBL5904001 | 0.74 | PDE10A (0.44) | CYSLTR1CYSLTR2PDE10ACYP1A2GPBAR1 | |
| SCHEMBL6798820 | 0.74 | CYSLTR2 (0.53) | CYSLTR1CYSLTR2PDE10ACYP1A2CYP3A4 | |
| SCHEMBL8188980 | 0.73 | CYP1A2 (0.46) | CYSLTR1CYSLTR2PDE10ACYP1A2CYP3A4 | |
| SCHEMBL349015 | 0.73 | CYP1A2 (0.49) | CYSLTR1CYSLTR2PDE10ACYP1A2GPBAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0726903-B1 | MATRIX METALLOPROTEASE INHIBITORS | SYNTEX INC (US) | 1997-07-16 | — | — | EP | disclosed |
| EP-0726903-A1 | MATRIX METALLOPROTEASE INHIBITORS | SYNTEX INC (US) | 1996-08-21 | — | — | EP | disclosed |
| WO-1995012603-A1 | MATRIX METALLOPROTEASE INHIBITORS________________________________ | SYNTEX (U.S.A.) INC. (US) | 1995-05-11 | — | — | WO | disclosed |