Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29505515 | 0.83 | ADORA2A (0.33) | ADORA2AADORA1 | |
| SCHEMBL2321586 | 0.78 | ADORA2A (0.37) | ADORA2AADORA1ADORA3 | |
| SCHEMBL9052718 | 0.75 | ADORA2A (0.35) | ADORA2AADORA1ADORA3 | |
| SCHEMBL9050481 | 0.73 | SMN1; SMN2 (0.34) | ADORA2AADORA1ADORA3 | |
| SCHEMBL9059097 | 0.72 | ADORA2A (0.36) | ADORA2AADORA1ADORA3 | |
| SCHEMBL28052586 | 0.72 | ADORA2A (0.43) | ADORA2AADORA1ADORA3 | |
| SCHEMBL6685170 | 0.70 | ADORA2A (0.42) | ADORA2AADORA1ADORA3 | |
| SCHEMBL9051482 | 0.69 | ADORA2A (0.31) | ADORA2AADORA1ADORA3 | |
| SCHEMBL1559316 | 0.69 | ADORA2A (0.41) | ADORA2AADORA1ADORA3 | |
| SCHEMBL19010802 | 0.67 | ADORA2A (0.51) | ADORA2AADORA1ADORA3 |
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-1996034591-A1 | DIAMINOPYRAZOLE-CONTAINING COMPOSITIONS FOR COLOURING KERATIN FIBRES, COLOURING PROCESS, NOVEL DIAMINOPYRAZOLES AND METHOD FOR THEIR PREPARATION | L'OREAL (FR) | 1996-11-07 | — | — | WO | claimed |