Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OGT | O15294 | 3/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.48 |
| ▸ | STIM1 | Q13586 | 4/20 | 0.47 |
| ▸ | ORAI1 | Q96D31 | 4/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19182235 | 0.85 | OGT (0.52) | OGTPTGS2PTGS1CA12CA2 | |
| SCHEMBL1694849 | 0.82 | OGT (0.48) | OGTPTGS2PTGS1ALDH1A1KDM4E | |
| SCHEMBL10120527 | 0.82 | ABCG2 (0.46) | OGTALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL17071962 | 0.79 | SNCA (0.40) | OGTPTGS2PTGS1CYP1B1STIM1 | |
| SCHEMBL31581056 | 0.79 | STIM1 (0.46) | OGTSTIM1ORAI1CA12CA9 | |
| SCHEMBL14836638 | 0.79 | CYP1B1 (0.57) | PTGS2PTGS1CYP1B1STIM1ORAI1 | |
| SCHEMBL1694856 | 0.75 | KDM4E (0.55) | ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL17069699 | 0.75 | SNCA (0.38) | OGTPTGS2PTGS1CYP1B1STIM1 | |
| SCHEMBL4265804 | 0.75 | ALDH1A1 (0.57) | ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL12571591 | 0.75 | CA12 (0.66) | KDM4ECA12CA2CA9CA1 |
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 |