Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL6883591 | 0.92 | NPC1 (0.39) | — | |
| SCHEMBL7996476 | 0.88 | ALDH1A1 (0.35) | — | |
| SCHEMBL2517442 | 0.88 | ALDH1A1 (0.35) | — | |
| SCHEMBL28180007 | 0.88 | ALDH1A1 (0.35) | — | |
| SCHEMBL14562749 | 0.88 | ALDH1A1 (0.35) | — | |
| SCHEMBL28807262 | 0.88 | ALDH1A1 (0.35) | — | |
| SCHEMBL27979361 | 0.88 | ALDH1A1 (0.35) | — | |
| SCHEMBL3913647 | 0.83 | NPC1 (0.43) | — | |
| SCHEMBL6292615 | 0.83 | MMP3 (0.50) | — | |
| SCHEMBL6535088 | 0.83 | CYP2D6 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1903855-A | Preparation method of unsym-substituted mcso tetraaryl porphyrin kind compound | UNIV ZHEJIANG (CN) | 2007-01-31 | — | — | CN | disclosed |