Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 7/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | HPGDS | O60760 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19262602 | 0.89 | — | — | |
| SCHEMBL15235777 | 0.87 | — | — | |
| SCHEMBL156827 | 0.87 | — | — | |
| SCHEMBL254427 | 0.83 | ANPEP (0.41) | ANPEP | |
| SCHEMBL1109123 | 0.82 | CA2 (0.47) | ANPEPHPGDS | |
| SCHEMBL253921 | 0.82 | CA2 (0.47) | ANPEPHPGDS | |
| SCHEMBL10272727 | 0.82 | CA2 (0.47) | ANPEPHPGDS | |
| SCHEMBL1109169 | 0.82 | CA2 (0.47) | ANPEPHPGDS | |
| SCHEMBL10272821 | 0.80 | LMNA (0.43) | PTGS1 | |
| SCHEMBL1912162 | 0.80 | NPC1 (0.45) | ANPEPHPGDS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012031298-A2 | ETHYNYLBENZENE DERIVATIVES | DUKE UNIVERSITY (US) | 2012-03-08 | — | — | WO | disclosed |