Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | CNR2 | P34972 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | VEGFA | P15692 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1937391 | 0.86 | CNR2 (0.59) | SLC6A3SLC6A2CNR2TP53MRGPRX4 | |
| SCHEMBL21044529 | 0.83 | SMN1; SMN2 (0.49) | TP53CYP1A2MAPTNPC1SMN1; SMN2 | |
| SCHEMBL4592907 | 0.82 | CNR2 (0.65) | SLC6A3CNR2 | |
| SCHEMBL19915788 | 0.82 | ALDH1A1 (0.55) | CYP1A2MAPTSMN1; SMN2GAARECQL | |
| SCHEMBL1938088 | 0.81 | CNR2 (0.49) | SLC6A3SLC6A2CNR2MRGPRX4PLA2G2A | |
| SCHEMBL9034755 | 0.81 | MAPK1 (0.48) | TP53CYP1A2MAPTNPC1SMN1; SMN2 | |
| SCHEMBL3511154 | 0.81 | SLC6A3 (0.55) | SLC6A3SLC6A2MAPTNPC1SMN1; SMN2 | |
| SCHEMBL17595088 | 0.80 | KMO (0.58) | CNR2NPC1RAB9AL3MBTL1EGLN1 | |
| SCHEMBL7827008 | 0.79 | PLAU (0.59) | SLC6A3SLC6A2MAPTNPC1RAB9A | |
| SCHEMBL24994712 | 0.79 | CNR2 (0.52) | SLC6A3SLC6A2CNR2MRGPRX4ABL1 |
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-3191451-B1 | 4-SUBSTITUTED PYRIDINE-2,6-DICARBOXYLIC ACID DERIVATIVES AND METHOD OF PREPARING SAME | OKINAWA INST SCIENCE & TECH SCHOOL CORP (JP) | 2019-06-05 | — | — | EP | claimed |