Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | DAO | P14920 | 2/20 | 0.41 |
| ▸ | DDO | Q99489 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL498622 | 0.96 | ALDH1A1 (0.46) | KDM4EALDH1A1GAAGABRA1GABRB2 | |
| SCHEMBL31158567 | 0.94 | ALDH1A1 (0.44) | KDM4EALDH1A1GAAGABRA1GABRB2 | |
| Formic Acid SCHEMBL29102709 | 0.91 | KDM4E (0.43) | KDM4EALDH1A1GAAGABRA1GABRB2 | |
| Hydroquinone SCHEMBL28096382 | 0.91 | GABRA1 (0.45) | KDM4EALDH1A1GAAGABRA1GABRB2 | |
| SCHEMBL544574 | 0.90 | ALDH1A1 (0.47) | KDM4EALDH1A1GAAGABRA1GABRB2 | |
| SCHEMBL2987953 | 0.89 | ALDH1A1 (0.46) | KDM4EALDH1A1GAAGABRA1GABRB2 | |
| SCHEMBL3930258 | 0.84 | MTNR1A (0.40) | KDM4EALDH1A1GAATDP1MEN1 | |
| Ether SCHEMBL28163199 | 0.83 | ALDH1A1 (0.41) | KDM4EALDH1A1GAATDP1CYP1A2 | |
| SCHEMBL6889822 | 0.82 | CYP1A2 (0.58) | KDM4EALDH1A1GAAGABRA1GABRB2 | |
| 1-Hydroxy-4-Ethoxybenzene SCHEMBL10588499 | 0.81 | LTA4H (0.50) | GAATDP1MEN1KMT2AMTNR1A |
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-106045838-A | 2-EAQ (2-ethylanthraquinone) synthesis device and technology | 江阴市长江化工有限公司 | 2016-10-26 | — | — | CN | disclosed |