Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | ADH1B | P00325 | 1/20 | 0.38 |
| ▸ | ADH1C | P00326 | 1/20 | 0.38 |
| ▸ | ADH1A | P07327 | 1/20 | 0.38 |
| ▸ | ADH4 | P08319 | 1/20 | 0.38 |
| ▸ | ADH7 | P40394 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.33 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.32 |
| ▸ | GAPDH | P04406 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8600060 | 0.79 | CA1 (0.43) | OPRM1ADH1BADH1CADH1AADH4 | |
| SCHEMBL10496304 | 0.77 | CA1 (0.42) | OPRM1ADH1BADH1CADH1AADH4 | |
| SCHEMBL15288444 | 0.77 | CA1 (0.42) | OPRM1ADH1BADH1CADH1AADH4 | |
| SCHEMBL28823662 | 0.77 | CA1 (0.42) | OPRM1ADH1BADH1CADH1AADH4 | |
| SCHEMBL10496296 | 0.77 | CA1 (0.42) | OPRM1ADH1BADH1CADH1AADH4 | |
| SCHEMBL23491317 | 0.77 | ADH1B (0.39) | OPRM1ADH1BADH1CADH1AADH4 | |
| SCHEMBL10496299 | 0.77 | CA1 (0.42) | OPRM1ADH1BADH1CADH1AADH4 | |
| SCHEMBL15288442 | 0.77 | CA1 (0.42) | OPRM1ADH1BADH1CADH1AADH4 | |
| SCHEMBL10496302 | 0.77 | CA1 (0.42) | OPRM1ADH1BADH1CADH1AADH4 | |
| SCHEMBL15141969 | 0.77 | ADH1B (0.39) | OPRM1ADH1BADH1CADH1AADH4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2534154-B1 | MACROCYCLES AS FACTOR XIA INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2020-08-05 | — | — | EP | disclosed |
| WO-2012046736-A1 | ORGANIC EL DEVICE, AND METHOD FOR PRODUCING SAME | 住友化学株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |