Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL253489 | 0.77 | TBXAS1 (0.31) | CYP2D6CYP2C9 | |
| SCHEMBL6766728 | 0.77 | CYP2D6 (0.35) | CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5254451 | 0.74 | ALDH1A1 (0.42) | CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL30944028 | 0.74 | DGAT1 (0.34) | CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL15529733 | 0.71 | TBXAS1 (0.36) | — | |
| SCHEMBL6766727 | 0.68 | — | — | |
| SCHEMBL18586731 | 0.67 | CYP11B1 (0.33) | — | |
| SCHEMBL7630451 | 0.67 | TBXAS1 (0.33) | — | |
| SCHEMBL1529995 | 0.63 | TOP2A (0.30) | — | |
| SCHEMBL20479677 | 0.63 | TBXAS1 (0.35) | CYP1A2CYP2D6CYP2C9CYP2C19 |
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-2346824-A1 | NOVEL ESTROGEN RECEPTOR LIGANDS | KARO BIO AB (SE) | 2011-07-27 | — | — | EP | disclosed |
| WO-2010031852-A1 | NOVEL ESTROGEN RECEPTOR LIGANDS | KARO BIO AB (SE) | 2010-03-25 | — | — | WO | disclosed |