Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 2/20 | 0.52 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.52 |
| ▸ | PNP | P00491 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.51 |
| ▸ | PDE2A | O00408 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.51 |
| ▸ | NT5E | P21589 | 5/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.44 |
| ▸ | CD99 | P14209 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20333764 | 0.88 | PDE4D (0.52) | PDE4DPDE3APNPLMNATP53 | |
| SCHEMBL24601222 | 0.88 | PDE4D (0.52) | PDE4DPDE3APNPLMNATP53 | |
| SCHEMBL22065053 | 0.85 | ADORA3 (0.51) | SMN1; SMN2ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL22508607 | 0.85 | ADORA3 (0.51) | SMN1; SMN2ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL20334131 | 0.84 | NT5E (0.53) | ADORA3NT5ECA1CA2CA4 | |
| SCHEMBL20347249 | 0.82 | NT5E (0.36) | PDE4DPDE3APNPLMNATP53 | |
| SCHEMBL20059149 | 0.82 | ADORA3 (0.60) | PDE4DPDE3APNPLMNATP53 | |
| SCHEMBL3436977 | 0.81 | PDE4D (0.66) | PDE4DPDE3APNPLMNATP53 | |
| SCHEMBL19959557 | 0.81 | PDE4D (0.66) | PDE4DPDE3APNPLMNATP53 | |
| SCHEMBL3436979 | 0.81 | PDE4D (0.66) | PDE4DPDE3APNPLMNATP53 |
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-2018119284-A1 | ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF | CALITHERA BIOSCIENCES, INC. (US) | 2018-06-28 | — | — | WO | disclosed |