Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 4/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL9893710 | 0.85 | CES2 (0.36) | KDM4E | |
| SCHEMBL146988 | 0.71 | CES2 (0.42) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL5773829 | 0.69 | HSD17B10 (0.44) | ALDH1A1 | |
| SCHEMBL1905745 | 0.69 | ENPP2 (0.46) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL30331273 | 0.69 | ENPP2 (0.46) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL3319704 | 0.67 | ENPP2 (0.35) | ENPP2 | |
| SCHEMBL3784650 | 0.67 | ALOX15 (0.47) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL61913 | 0.67 | ALDH1A1 (0.50) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL7166242 | 0.67 | ENPP2 (0.44) | ENPP2CA4CA6CA5ACA7 | |
| SCHEMBL18840034 | 0.65 | ALDH1A1 (0.47) | CA4CA6CA5ACA14CA5B |
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-2776404-B1 | HETEROCYCLIC ANALOGS OF PROPARGYL-LINKED INHIBITORS OF DIHYDROFOLATE REDUCTASE | UNIV CONNECTICUT (US) | 2016-07-06 | — | — | EP | disclosed |