Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 2/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27915737 | 0.82 | CYP3A4 (0.62) | CYP3A4ALDH1A1CYP1A2CYP2C19TSHR | |
| SCHEMBL29510136 | 0.80 | CYP3A4 (1.00) | CYP3A4ALDH1A1CYP1A2CYP2C19TSHR | |
| SCHEMBL306160 | 0.80 | CYP3A4 (1.00) | CYP3A4ALDH1A1CYP1A2CYP2C19TSHR | |
| SCHEMBL10048027 | 0.79 | CYP3A4 (0.74) | CYP3A4ALDH1A1CYP1A2CYP2C19TSHR | |
| SCHEMBL9392819 | 0.79 | CYP3A4 (0.56) | CYP3A4ALDH1A1CYP1A2CYP2C19MEN1 | |
| SCHEMBL29067208 | 0.79 | CYP3A4 (0.74) | CYP3A4ALDH1A1CYP1A2CYP2C19TSHR | |
| SCHEMBL11884274 | 0.79 | CYP3A4 (0.74) | CYP3A4ALDH1A1CYP1A2CYP2C19TSHR | |
| SCHEMBL31053868 | 0.78 | CYP3A4 (0.77) | CYP3A4ALDH1A1CYP1A2CYP2C19NAAA | |
| SCHEMBL1171492 | 0.78 | CYP3A4 (0.77) | CYP3A4ALDH1A1CYP1A2CYP2C19NAAA | |
| SCHEMBL30800034 | 0.78 | CYP3A4 (0.72) | CYP3A4ALDH1A1CYP1A2CYP2C19TSHR |
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-2012024558-A2 | LIGHT MEDIATED REGULATION OF PROTEIN DIMERIZATION | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2012-02-23 | — | — | WO | disclosed |