Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.45 |
| ▸ | ADA | P00813 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | NT5E | P21589 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19535505 | 0.91 | ADORA2A (0.46) | ADORA2AADALMNANT5EHIF1A | |
| SCHEMBL19536694 | 0.90 | ADORA2A (0.42) | ADORA2AADALMNANT5EHIF1A | |
| SCHEMBL19537284 | 0.90 | ADORA2A (0.42) | ADORA2AADALMNANT5EHIF1A | |
| SCHEMBL19535918 | 0.90 | ADORA2A (0.48) | ADORA2AADALMNAADORA3ADORA1 | |
| SCHEMBL21006854 | 0.90 | ADORA2A (0.48) | ADORA2AADALMNAADORA3ADORA1 | |
| SCHEMBL19536589 | 0.90 | ADORA2A (0.48) | ADORA2AADAADORA3ADORA1ADORA2B | |
| SCHEMBL19536548 | 0.90 | ADORA2A (0.48) | ADORA2AADAADORA3ADORA1ADORA2B | |
| SCHEMBL19537249 | 0.89 | ADORA2A (0.44) | ADORA2AADALMNANT5EHIF1A | |
| SCHEMBL19535988 | 0.89 | ADORA3 (0.46) | ADORA2ANT5EADORA3PDE3A | |
| SCHEMBL19536425 | 0.88 | ADORA2A (0.47) | ADORA2AADALMNANT5EHIF1A |
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-2017189978-A1 | ALKYNE CONTAINING NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO | EMORY UNIVERSITY (US) | 2017-11-02 | — | — | WO | disclosed |