Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20807130 | 0.80 | PARP1 (0.40) | ALDH1A1PARP1MAPTALOX15NPC1 | |
| SCHEMBL22474786 | 0.80 | HPGD (0.40) | ALDH1A1 | |
| SCHEMBL23837552 | 0.80 | MTNR1A (0.36) | MTNR1AMTNR1BCYP1A2MAPTCYP2C9 | |
| SCHEMBL18966760 | 0.78 | PARP1 (0.34) | PARP1MTNR1AMTNR1B | |
| SCHEMBL15861578 | 0.76 | ALDH1A1 (0.34) | ALDH1A1PARP1MAPK1 | |
| SCHEMBL15861579 | 0.76 | ALDH1A1 (0.34) | ALDH1A1PARP1MAPK1 | |
| SCHEMBL23130227 | 0.75 | KMT2A (0.44) | — | |
| SCHEMBL23837606 | 0.74 | ALDH1A1 (0.43) | ALDH1A1 | |
| SCHEMBL23129889 | 0.73 | ALDH1A1 (0.43) | ALDH1A1MAPK1MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL23130114 | 0.71 | TSHR (0.37) | ALDH1A1MTNR1AMTNR1BMAPT |
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-3145936-B1 | BORONIC ACID DERIVATIVES AND THERAPEUTIC USES THEREOF | QPEX BIOPHARMA INC (US) | 2020-09-30 | — | — | EP | disclosed |