Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 6/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 6/20 | 0.39 |
| ▸ | ERN1 | O75460 | 3/20 | 0.39 |
| ▸ | PRKDC | P78527 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.38 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.36 |
| ▸ | ABAT | P80404 | 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 | |
|---|---|---|---|---|
| SCHEMBL6015905 | 0.73 | — | — | |
| SCHEMBL29953071 | 0.71 | GRIA1 (0.41) | ALDH1A1TSHRTDP1KDM4EERN1 | |
| SCHEMBL13946720 | 0.71 | EHMT2 (0.55) | ALDH1A1TSHRTDP1KDM4EPDE3B | |
| SCHEMBL12409005 | 0.70 | — | — | |
| SCHEMBL11712262 | 0.70 | ALDH1A1 (0.40) | ALDH1A1TSHRKDM4EPDE3BPDE3A | |
| SCHEMBL25296768 | 0.69 | MAPT (0.49) | ALDH1A1KDM4EPDE3BPDE3A | |
| SCHEMBL28823897 | 0.69 | KDM4E (0.54) | ALDH1A1TSHRKDM4EAOX1HPGD | |
| SCHEMBL31501965 | 0.68 | CYP2A6 (0.37) | ALDH1A1TSHRTDP1KDM4EERN1 | |
| SCHEMBL3558751 | 0.68 | ALDH1A1 (0.58) | ALDH1A1TSHRTDP1KDM4EPDE3B | |
| SCHEMBL26660799 | 0.68 | CYP2A6 (0.37) | ALDH1A1TSHRTDP1KDM4EERN1 |
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 |