Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 3/20 | 0.40 |
| ▸ | ADH1A | P07327 | 3/20 | 0.40 |
| ▸ | ADH7 | P40394 | 3/20 | 0.40 |
| ▸ | ADH1C | P00326 | 2/20 | 0.40 |
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | ADH4 | P08319 | 1/20 | 0.39 |
| ▸ | KDM5A | P29375 | 4/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.37 |
| ▸ | PHF8 | Q9UPP1 | 2/20 | 0.37 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM4A | O75164 | 1/20 | 0.35 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16995384 | 0.89 | PAOX (0.50) | ADH1BADH1AADH7ADH1CPAOX | |
| SCHEMBL16995352 | 0.88 | ADH1B (0.36) | ADH1BADH1AADH7ADH1CPAOX | |
| SCHEMBL18938102 | 0.85 | CAMK2A (0.32) | ADH1BADH1AADH7PAOXKDM5A | |
| SCHEMBL16995418 | 0.84 | PAOX (0.49) | ADH1BADH1AADH7ADH1CPAOX | |
| SCHEMBL1400994 | 0.81 | LMNA (0.55) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL1401106 | 0.81 | — | — | |
| SCHEMBL16207308 | 0.81 | ADH1B (0.48) | ADH1BADH1AADH7ADH1CPAOX | |
| SCHEMBL16995353 | 0.79 | ADH1B (0.43) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL770728 | 0.79 | PRMT1 (0.58) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL26904254 | 0.79 | PRMT1 (0.58) | ADH1BADH1AADH7ADH1CEPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2576586-B1 | C-28 AMIDES OF MODIFIED C-3 BETULINIC ACID DERIVATIVES AS HIV MATURATION INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2015-08-12 | — | — | EP | disclosed |