Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | RARG | P13631 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.33 |
| ▸ | KISS1R | Q969F8 | 1/20 | 0.33 |
| ▸ | NPY4R | P50391 | 9/20 | 0.32 |
| ▸ | NPY5R | Q15761 | 9/20 | 0.32 |
| ▸ | NPY1R | P25929 | 8/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11268857 | 0.91 | KISS1R (0.37) | CYP1A2CYP3A4CYP2C19KISS1RNPY4R | |
| SCHEMBL10919519 | 0.86 | NPY4R (0.44) | NPY4RNPY5RNPY1RNPY2RFCER2 | |
| SCHEMBL10919416 | 0.86 | NPY4R (0.39) | OPRK1NPY4RNPY5RNPY1RNPY2R | |
| SCHEMBL9068526 | 0.85 | NPY4R (0.40) | NPY4RNPY5RNPY1RNPY2RMME | |
| SCHEMBL10916522 | 0.83 | CYP1A2 (0.37) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL10914759 | 0.83 | NPY4R (0.34) | CYP1A2KISS1RNPY4RNPY5RNPY1R | |
| SCHEMBL10918462 | 0.82 | NPY4R (0.44) | OPRK1NPY4RNPY5RNPY1RNPY2R | |
| SCHEMBL11207356 | 0.79 | NPY4R (0.46) | NPY4RNPY5RNPY1RNPY2R | |
| SCHEMBL10922325 | 0.79 | CYP1A2 (0.35) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11209304 | 0.79 | MMP8 (0.39) | CYP3A4CYP2C19KISS1RMMECPB2 |
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-0067429-A1 | Inhibitors of mammalian collagenase | E.R. Squibb & Sons, Inc. (US) | 1982-12-22 | — | — | EP | disclosed |