Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5320300 | 0.80 | GRIN1 (0.37) | GRIN1GRIN2BCYP19A1CYP3A4 | |
| SCHEMBL7889098 | 0.79 | GRIN1 (0.39) | GRIN1GRIN2BCYP19A1CYP3A4 | |
| SCHEMBL7878123 | 0.72 | GRIN1 (0.38) | GRIN1GRIN2BCYP19A1CYP3A4 | |
| SCHEMBL7878120 | 0.72 | GRIN1 (0.38) | GRIN1GRIN2BCYP19A1CYP3A4 | |
| SCHEMBL7878122 | 0.70 | GRIN1 (0.40) | GRIN1GRIN2BCYP19A1CYP3A4 | |
| SCHEMBL8639692 | 0.70 | GRIN1 (0.40) | GRIN1GRIN2BCYP19A1CYP3A4 | |
| SCHEMBL27401941 | 0.69 | CYP19A1 (0.67) | GRIN1GRIN2BCYP19A1CYP3A4 | |
| SCHEMBL6820039 | 0.67 | GRIN1 (0.42) | GRIN1GRIN2BCYP19A1CYP3A4 | |
| SCHEMBL5320301 | 0.65 | GRIN1 (0.40) | GRIN1GRIN2BCYP3A4 | |
| SCHEMBL10956513 | 0.64 | SHBG (0.39) | GRIN1GRIN2BCYP19A1CYP3A4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6180803-B1 | STEROID DRUGS | LABORATOIRE THERAMEX (MC) | 2001-01-30 | — | — | US | disclosed |
| EP-0886645-B1 | NEW 19-NOR-PREGNENE DERIVATIVES | THERAMEX (MC) | 1999-09-01 | — | — | EP | disclosed |
| WO-1997027209-A1 | NEW SUBSTITUTED 19-NOR-PREGNANE DERIVATIVES | LABORATOIRE THERAMEX (MC) | 1997-07-31 | — | — | WO | disclosed |
| EP-0785212-A1 | New 19-nor-pregnene derivatives | LABORATOIRE THERAMEX (MC) | 1997-07-23 | — | — | EP | disclosed |
| EP-0785211-A1 | New substituted 19-nor-pregnane derivatives | LABORATOIRE THERAMEX (MC) | 1997-07-23 | — | — | EP | disclosed |