Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11631985 | 1.00 | ADORA2A (0.48) | ADORA2APIK3CGPIK3CAPIK3CBHDAC6 | |
| SCHEMBL23270838 | 0.83 | PIK3CG (0.38) | ADORA2APIK3CGPIK3CAPIK3CBHDAC6 | |
| SCHEMBL14268538 | 0.82 | ADORA2A (0.48) | ADORA2APIK3CGPIK3CAPIK3CBHDAC6 | |
| SCHEMBL23028939 | 0.79 | ADORA2A (0.46) | ADORA2APIK3CGPIK3CAPIK3CBHDAC6 | |
| SCHEMBL3692533 | 0.75 | ADORA2A (0.57) | ADORA2APIK3CGPIK3CAPIK3CBHDAC6 | |
| SCHEMBL27744565 | 0.75 | MPO (0.53) | DHFRNOS1 | |
| SCHEMBL10960826 | 0.74 | DHFR (0.61) | PIK3CGHDAC6DHFR | |
| SCHEMBL10960821 | 0.74 | DHFR (0.61) | PIK3CGHDAC6DHFR | |
| Hydrochloric Acid SCHEMBL29027559 | 0.73 | ADORA2A (0.43) | ADORA2APIK3CGPIK3CAPIK3CBHDAC6 | |
| SCHEMBL3537607 | 0.73 | ADORA2A (0.55) | ADORA2APIK3CGPIK3CAPIK3CBHDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |