Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.61 |
| ▸ | ALPG | P10696 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 3/20 | 0.52 |
| ▸ | CASP3 | P42574 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALB | P02768 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10436941 | 1.00 | NQO1 (0.61) | NQO1ALPGMAOBCASP3KDM4E | |
| SCHEMBL29951008 | 0.81 | NQO1 (0.61) | NQO1KDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL29953437 | 0.81 | NQO1 (0.61) | NQO1MAOBKDM4EMAPTMEN1 | |
| SCHEMBL11568363 | 0.81 | NQO1 (0.61) | NQO1MAOBKDM4EMAPTMEN1 | |
| SCHEMBL3196866 | 0.81 | CA2 (0.57) | NQO1ALPGMAOBCASP3KDM4E | |
| SCHEMBL29953189 | 0.81 | CA12 (0.62) | NQO1KDM4EALDH1A1CA9CA2 | |
| SCHEMBL29951607 | 0.81 | NQO1 (0.59) | NQO1MAOBCASP3KDM4ECYP3A4 | |
| SCHEMBL11415283 | 0.81 | NQO1 (0.64) | NQO1MAOBCASP3KDM4EMAPT | |
| SCHEMBL2232638 | 0.77 | KDM4E (0.59) | NQO1MAOBCASP3KDM4EMAPT | |
| SCHEMBL29209094 | 0.77 | NQO1 (0.64) | NQO1MAOBKDM4EMAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |