Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.73 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.73 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.71 |
| ▸ | THPO | P40225 | 1/20 | 0.71 |
| ▸ | MEN1 | O00255 | 1/20 | 0.71 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.71 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.71 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.71 |
| ▸ | BLM | P54132 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL9021935 | 1.00 | ADORA2A (0.73) | ADORA2AADORA1ADORA2BCYP1A2THPO | |
| SCHEMBL5035572 | 0.89 | ADORA2A (0.78) | ADORA2AADORA1ADORA2BCYP1A2THPO | |
| SCHEMBL9022509 | 0.84 | ADORA2A (0.86) | ADORA2AADORA2BCYP1A2THPOMEN1 | |
| SCHEMBL9022511 | 0.84 | ADORA2A (0.86) | ADORA2AADORA2BCYP1A2THPOMEN1 | |
| SCHEMBL9022550 | 0.84 | ADORA2A (0.68) | ADORA2AADORA1ADORA2BCYP1A2THPO | |
| SCHEMBL9022538 | 0.84 | ADORA2A (0.68) | ADORA2AADORA1ADORA2BCYP1A2THPO | |
| SCHEMBL8838160 | 0.84 | ADORA2A (0.82) | ADORA2AADORA1ADORA2BCYP1A2THPO | |
| SCHEMBL8838178 | 0.84 | ADORA2A (0.82) | ADORA2AADORA1ADORA2BCYP1A2THPO | |
| SCHEMBL9021645 | 0.84 | ADORA2A (0.79) | ADORA2AADORA2BCYP1A2THPOMEN1 | |
| SCHEMBL9021625 | 0.84 | ADORA2A (0.79) | ADORA2AADORA2BCYP1A2THPOMEN1 |
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-0704215-A2 | Inhibitor of vascular permeability enhancer | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-04-03 | — | — | EP | disclosed |