Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 6/20 | 0.32 |
| ▸ | DRD2 | P14416 | 5/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 2/20 | 0.30 |
| ▸ | SMYD3 | Q9H7B4 | 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 | |
|---|---|---|---|---|
| SCHEMBL4853543 | 0.74 | CYP24A1 (0.33) | DRD3DRD2SGPL1HTR1ADRD4 | |
| SCHEMBL2419510 | 0.71 | MEN1 (0.31) | — | |
| SCHEMBL5722716 | 0.70 | CYP3A4 (0.42) | DRD3DRD2CYP3A4CYP2C8S1PR3 | |
| SCHEMBL7793664 | 0.70 | CYP3A4 (0.42) | DRD3DRD2CYP3A4CYP2C8S1PR3 | |
| SCHEMBL31545566 | 0.69 | CYP3A4 (0.42) | DRD3DRD2CYP3A4CYP2C8S1PR3 | |
| SCHEMBL24225295 | 0.69 | ACACB (0.35) | — | |
| SCHEMBL7792870 | 0.68 | CYP3A4 (0.40) | DRD3DRD2CYP3A4CYP2C8S1PR3 | |
| SCHEMBL7793326 | 0.68 | CYP3A4 (0.40) | DRD3DRD2CYP3A4CYP2C8S1PR3 | |
| SCHEMBL10893945 | 0.67 | CYP1A2 (0.37) | CYP2D6CYP2C9CYP2C19DPP4 | |
| SCHEMBL10893934 | 0.67 | CYP1A2 (0.37) | CYP2D6CYP2C9CYP2C19DPP4 |
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-1551820-A2 | ESTROGEN RECEPTOR MODULATORS | Merck & Co., Inc. (US) | 2005-07-13 | — | — | EP | disclosed |
| WO-2004026887-A2 | ESTROGEN RECEPTOR MODULATORS | MERCK & CO., INC. (US) | 2004-04-01 | — | — | WO | disclosed |