Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28418542 | 0.74 | SRC (0.36) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28025881 | 0.74 | — | — | |
| SCHEMBL28839685 | 0.72 | PLA2G2A (0.31) | — | |
| SCHEMBL29140526 | 0.71 | MCHR1 (0.31) | — | |
| SCHEMBL28890813 | 0.68 | BACE1 (0.38) | NPC1ALDH1A1MAPT | |
| SCHEMBL7259993 | 0.66 | KDM4E (0.35) | ALDH1A1MAPT | |
| SCHEMBL28188074 | 0.65 | — | — | |
| Iodide SCHEMBL2313827 | 0.65 | PDE5A (0.38) | CYP1A2CYP19A1CYP2C9CYP2C19MAPT | |
| SCHEMBL28008851 | 0.64 | — | — | |
| SCHEMBL21523874 | 0.64 | RARB (0.40) | CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111349102-A | D-pi-A zinc porphyrin complex, synthesis thereof and application thereof in preparation of dye-sensitized solar cell | 西北师范大学 | 2020-06-30 | — | — | CN | claimed |
| CN-111349102-A | D-pi-A zinc porphyrin complex, synthesis thereof and application thereof in preparation of dye-sensitized solar cell | 西北师范大学 | 2020-06-30 | — | — | CN | disclosed |