Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.46 |
| ▸ | ADH1C | P00326 | 1/20 | 0.46 |
| ▸ | ADH1A | P07327 | 1/20 | 0.46 |
| ▸ | ADH4 | P08319 | 1/20 | 0.46 |
| ▸ | ADH7 | P40394 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8165369 | 0.95 | CYP2D6 (0.47) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL157039 | 0.93 | EPHX1 (0.50) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL524625 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL30478821 | 0.88 | TDP1 (0.44) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL22043849 | 0.82 | TDP1 (0.40) | CYP2D6EPHX1KDM4EKMT2AALDH1A1 | |
| SCHEMBL8991907 | 0.82 | TDP1 (0.40) | CYP2D6EPHX1KDM4EKMT2AALDH1A1 | |
| SCHEMBL24034733 | 0.80 | SAT1 (0.39) | CYP2D6KDM4EKMT2AALDH1A1MEN1 | |
| SCHEMBL8991891 | 0.80 | TDP1 (0.39) | CYP2D6EPHX1KDM4EKMT2AALDH1A1 | |
| SCHEMBL1808210 | 0.80 | GABRA5 (0.53) | EPHX1EPHX2 | |
| SCHEMBL31688784 | 0.80 | EPHX1 (0.42) | EPHX1KDM4EKMT2AL3MBTL1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118265718-A | Radiolabeled compounds and uses thereof | 国立大学法人大阪大学 | 2024-06-28 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |