Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 3/20 | 0.56 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | LTA4H | P09960 | 3/20 | 0.49 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8778097 | 0.90 | NR5A1 (0.56) | RARBNR5A1TP53TSHRLTA4H | |
| SCHEMBL10992680 | 0.90 | NR5A1 (0.56) | RARBNR5A1TP53TSHRLTA4H | |
| SCHEMBL9150611 | 0.86 | RARB (0.71) | RARBNR5A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7775244 | 0.86 | RARB (0.71) | RARBNR5A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9150185 | 0.86 | RARB (0.71) | RARBNR5A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2204178 | 0.86 | RARB (0.71) | RARBNR5A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9153965 | 0.86 | RARB (0.71) | RARBNR5A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9155028 | 0.86 | RARB (0.71) | RARBNR5A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14267492 | 0.86 | RARB (0.71) | RARBNR5A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9154663 | 0.86 | RARB (0.71) | RARBNR5A1CYP3A4CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5139696-A | Hydrogen-bonded liquid crystal complexes | CORNELL RESEARCH FOUNDATION, INC. (US) | 1992-08-18 | — | — | US | disclosed |
| US-5037574-A | Hydrogen-bonded liquid crystal complexes | CORNELL RESEARCH FOUNDATION, INC. (US) | 1991-08-06 | — | — | US | disclosed |