Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 7/20 | 0.60 |
| ▸ | DRD1 | P21728 | 1/20 | 0.60 |
| ▸ | GNRHR | P30968 | 1/20 | 0.60 |
| ▸ | MRGPRX2 | Q96LB1 | 1/20 | 0.60 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.59 |
| ▸ | NMUR2 | Q9GZQ4 | 5/20 | 0.57 |
| ▸ | NMUR1 | Q9HB89 | 5/20 | 0.57 |
| ▸ | EPHA2 | P29317 | 2/20 | 0.53 |
| ▸ | NPY4R | P50391 | 4/20 | 0.52 |
| ▸ | NPY1R | P25929 | 3/20 | 0.52 |
| ▸ | NPY2R | P49146 | 3/20 | 0.52 |
| ▸ | NPY5R | Q15761 | 3/20 | 0.52 |
| ▸ | KDM1A | O60341 | 1/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29390426 | 0.94 | OPRM1 (0.61) | OPRM1DRD1GNRHRMRGPRX2ABCB11 | |
| SCHEMBL29619531 | 0.89 | NPY4R (0.58) | OPRM1DRD1GNRHRMRGPRX2ABCB11 | |
| SCHEMBL30293724 | 0.86 | NPY4R (0.56) | OPRM1DRD1GNRHRMRGPRX2ABCB11 | |
| Acetic Acid SCHEMBL29697246 | 0.84 | ABCB11 (0.76) | OPRM1DRD1GNRHRMRGPRX2ABCB11 | |
| SCHEMBL29558705 | 0.84 | OPRM1 (0.64) | OPRM1NMUR2NMUR1KDM1AOPRK1 | |
| SCHEMBL24040282 | 0.83 | OPRM1 (0.49) | OPRM1DRD1GNRHRMRGPRX2ABCB11 | |
| SCHEMBL30634740 | 0.83 | NMUR2 (0.65) | OPRM1NMUR2NMUR1EPHA2NPY4R | |
| SCHEMBL25941553 | 0.82 | NMUR2 (0.56) | OPRM1NMUR2NMUR1EPHA2NPY4R | |
| Cetrorelix SCHEMBL24040283 | 0.82 | GNRHR (0.89) | OPRM1DRD1GNRHRMRGPRX2ABCB11 | |
| Cetrorelix SCHEMBL30882997 | 0.82 | GNRHR (0.89) | OPRM1DRD1GNRHRMRGPRX2ABCB11 |
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-0973801-A1 | GnRH ANTAGONISTS | FERRING B.V. (NL) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998046635-A1 | GnRH ANTAGONISTS | FERRING BV (NL) | 1998-10-22 | — | — | WO | disclosed |