Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | QPCT | Q16769 | 1/20 | 0.47 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.46 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.46 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.46 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL256624 | 0.97 | CYP3A4 (0.52) | CYP3A4CYP1A2CYP2C9TSHRMAPT | |
| SCHEMBL29369633 | 0.80 | CYP3A4 (0.43) | CYP3A4CYP1A2CYP2C9TSHRMAPT | |
| SCHEMBL7015795 | 0.77 | CYP1A2 (0.59) | CYP1A2CYP2C9TSHRQPCTMEN1 | |
| SCHEMBL7808697 | 0.77 | ALDH1A1 (0.54) | CYP3A4CYP1A2CYP2C9TSHRMAPT | |
| SCHEMBL7013145 | 0.77 | CYP1A2 (0.44) | CYP3A4CYP1A2CYP2C9TSHRMAPT | |
| SCHEMBL12841363 | 0.77 | GABRG2 (0.68) | CYP3A4CYP1A2CYP2C9TSHRMAPT | |
| SCHEMBL11122638 | 0.70 | CYP2A6 (0.64) | CYP3A4CYP1A2HTTALDH1A1 | |
| SCHEMBL31440787 | 0.70 | CYP2A6 (0.64) | CYP3A4CYP1A2HTTALDH1A1 | |
| SCHEMBL1352015 | 0.70 | MAPT (0.56) | CYP3A4CYP1A2CYP2C9TSHRMAPT | |
| SCHEMBL6518759 | 0.70 | CYP2C9 (0.58) | CYP1A2CYP2C9TSHRMAPTQPCT |
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-115336028-A | Composition for light-emitting device, light-emitting apparatus, electronic device, and lighting apparatus | 株式会社半导体能源研究所 | 2022-11-11 | — | — | CN | disclosed |