Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.54 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | ACHE | P22303 | 3/20 | 0.54 |
| ▸ | USP2 | O75604 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.54 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | PDE2A | O00408 | 1/20 | 0.54 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.54 |
| ▸ | PDE5A | O76074 | 1/20 | 0.54 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3974591 | 1.00 | CYP3A4 (0.54) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 | |
| SCHEMBL17278085 | 0.89 | MAPT (0.45) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 | |
| SCHEMBL6640168 | 0.86 | TNF (0.47) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 | |
| SCHEMBL16431495 | 0.86 | APAF1 (0.48) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 | |
| SCHEMBL14538274 | 0.86 | TRPA1 (0.54) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 | |
| SCHEMBL16431829 | 0.86 | APAF1 (0.48) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 | |
| SCHEMBL15647963 | 0.79 | TNF (0.59) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 | |
| SCHEMBL20813447 | 0.79 | CYP3A4 (0.53) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 | |
| SCHEMBL5358941 | 0.79 | TNF (0.57) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 | |
| SCHEMBL15595899 | 0.79 | SMN1; SMN2 (0.57) | CYP3A4PDE10ASMN1; SMN2ACHEUSP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023055321-A1 | ANTI-INFLAMMATORY MICROEMULSION EYE FORMULATIONS DERIVED FROM NIGELLA SATIVA OIL | T.C. TRAKYA ÜNİVERSİTESİ (TR) | 2023-04-06 | — | — | WO | disclosed |