Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | DRD2 | P14416 | 4/20 | 0.43 |
| ▸ | DRD4 | P21917 | 4/20 | 0.43 |
| ▸ | DRD3 | P35462 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9855246 | 0.95 | CYP2C9 (0.41) | CYP2C9DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL9855058 | 0.95 | CYP2C9 (0.41) | CYP2C9DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL10509572 | 0.95 | CYP2C9 (0.41) | CYP2C9DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL9855342 | 0.95 | DRD2 (0.42) | CYP2C9DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL9855658 | 0.95 | CYP2C9 (0.43) | CYP2C9DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL9855626 | 0.94 | CYP2C9 (0.41) | CYP2C9DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL9855502 | 0.94 | CYP2C9 (0.41) | CYP2C9DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL9855110 | 0.93 | CYP2C9 (0.40) | CYP2C9DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL9855594 | 0.93 | DRD2 (0.42) | CYP2C9DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL9855295 | 0.91 | DRD2 (0.41) | CYP2C9DRD2DRD4DRD3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5068053-A | Liquid crystals for optical apparatus | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |