Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.41 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | FDPS | P14324 | 1/20 | 0.37 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.35 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.35 |
| ▸ | ABAT | P80404 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6435855 | 1.00 | TSHR (0.43) | TSHRALDH1A1CYP2A6ALDH1A3EGFR | |
| SCHEMBL1795902 | 0.84 | TSHR (0.43) | TSHRALDH1A1CYP2A6ALDH1A3EGFR | |
| SCHEMBL21479597 | 0.82 | XDH (0.44) | TSHRALDH1A1KDM4EPTGS2 | |
| SCHEMBL6899726 | 0.81 | ALDH1A1 (0.47) | TSHRALDH1A1CYP2A6EGFRKDM4E | |
| SCHEMBL16958999 | 0.80 | TSHR (0.43) | TSHRALDH1A1EGFRKDM4EPTGS2 | |
| SCHEMBL16952815 | 0.80 | TSHR (0.43) | TSHRALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL16249165 | 0.80 | ALDH1A1 (0.42) | TSHRALDH1A1CYP2A6ALDH1A3KDM4E | |
| SCHEMBL20590003 | 0.78 | ALDH1A1 (0.39) | TSHRALDH1A1CYP2A6ALDH1A3EGFR | |
| SCHEMBL13630983 | 0.77 | ALDH1A1 (0.40) | TSHRALDH1A1CYP2A6ALDH1A3EGFR | |
| SCHEMBL1395746 | 0.77 | ALDH1A1 (0.40) | TSHRALDH1A1CYP2A6ALDH1A3EGFR |
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 |