Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.68 |
| ▸ | NCK1 | P16333 | 1/20 | 0.63 |
| ▸ | BACE1 | P56817 | 1/20 | 0.63 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | NQO2 | P16083 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15831562 | 0.88 | CYP1A2 (0.55) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 | |
| SCHEMBL15831553 | 0.88 | CCR1 (0.59) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 | |
| SCHEMBL10147842 | 0.87 | CYP1A2 (0.59) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 | |
| SCHEMBL15831559 | 0.87 | CYP1A2 (0.58) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 | |
| SCHEMBL15824289 | 0.87 | CYP1A2 (0.63) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 | |
| SCHEMBL14269734 | 0.87 | CCR1 (0.61) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 | |
| SCHEMBL4128022 | 0.86 | CYP1A2 (0.57) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 | |
| SCHEMBL13298969 | 0.84 | CYP1A2 (0.55) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 | |
| SCHEMBL29692924 | 0.84 | PSMB5 (0.57) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 | |
| SCHEMBL8830006 | 0.84 | PSMB5 (0.57) | CYP1A2NCK1BACE1CYP2A6ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021074275-A1 | EFFECTIVE PHOTOMODULATION OF LANTHANIDE (III) ION LUMINESCENCE IN THE VISIBLE OR NEAR-INFRARED RANGE | UNIVERSITE DE RENNES 1 (FR) | 2021-04-22 | — | — | WO | disclosed |
| CN-105294776-B | A kind of preparation method of the symmetrical dimer of nitrogen heterocyclic ring aromatic compound | 兰州大学 | 2018-06-15 | — | — | CN | disclosed |
| CN-105294776-A | Method for preparing symmetric dimer of nitrogen heterocyclic ring aromatic compound | UNIV LANZHOU | 2016-02-03 | — | — | CN | disclosed |