Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10442596 | 0.73 | HCAR2 (0.46) | HCAR2AOC3ADORA2ACYP11B1CYP11B2 | |
| SCHEMBL9465935 | 0.72 | NPC1 (0.37) | — | |
| SCHEMBL9465604 | 0.70 | NPC1 (0.48) | CYP11B1CYP11B2 | |
| SCHEMBL9465991 | 0.69 | NOS1 (0.38) | ADORA2A | |
| SCHEMBL9465837 | 0.67 | GSK3B (0.31) | — | |
| SCHEMBL20175445 | 0.66 | HCAR2 (0.40) | HCAR2AOC3ADORA2ACYP11B1CYP11B2 | |
| SCHEMBL9465496 | 0.65 | HDAC8 (0.39) | — | |
| SCHEMBL14435919 | 0.65 | AOC3 (0.47) | HCAR2AOC3ADORA2A | |
| SCHEMBL5209803 | 0.65 | COMT (0.41) | — | |
| SCHEMBL2405110 | 0.64 | HPGDS (0.43) | HCAR2AOC3ADORA2A |
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-5246914-A | Fungicides and plant growth regulators | BASF AKTIENGESELLSCHAFT (DE) | 1993-09-21 | — | — | US | disclosed |