Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.49 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.49 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.49 |
| ▸ | ABAT | P80404 | 1/20 | 0.49 |
| ▸ | ERN1 | O75460 | 10/20 | 0.47 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
| ▸ | TLR2 | O60603 | 1/20 | 0.44 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.44 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.44 |
| ▸ | PRKDC | P78527 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27614940 | 1.00 | ALDH1A1 (0.52) | ALDH1A1TDP1KDM4ETSHRTRIM24 | |
| SCHEMBL16649152 | 0.93 | ALDH1A1 (0.57) | ALDH1A1TDP1KDM4ETSHRTRIM24 | |
| SCHEMBL5361924 | 0.86 | ALDH1A1 (0.69) | ALDH1A1TDP1KDM4ETSHRTRIM24 | |
| SCHEMBL1570740 | 0.84 | ALDH1A1 (0.72) | ALDH1A1TDP1KDM4ETSHRHPGD | |
| SCHEMBL27753912 | 0.84 | ALDH1A1 (0.72) | ALDH1A1TDP1KDM4ETSHRHPGD | |
| SCHEMBL31469616 | 0.84 | ALDH1A1 (0.72) | ALDH1A1TDP1KDM4ETSHRHPGD | |
| SCHEMBL24389243 | 0.82 | ALDH1A1 (0.57) | ALDH1A1TDP1KDM4ETSHRHPGD | |
| SCHEMBL1002368 | 0.82 | ALDH1A1 (0.69) | ALDH1A1TDP1KDM4ETSHRTRIM24 | |
| SCHEMBL6234401 | 0.82 | ERN1 (0.53) | ALDH1A1TDP1KDM4ETSHRTRIM24 | |
| SCHEMBL29459727 | 0.82 | ALDH1A1 (0.69) | ALDH1A1TDP1KDM4ETSHRTRIM24 |
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 |