Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMIGD3 | P0DMS9 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.40 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.40 |
| ▸ | PELI1 | Q96FA3 | 2/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 3/20 | 0.37 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.36 |
| ▸ | TOP2A | P11388 | 1/20 | 0.35 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5924659 | 0.71 | CYP2A6 (0.56) | CYP2A6CYP2B6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL7995665 | 0.69 | ERN1 (0.50) | TMIGD3ADORA2AADORA1CYP2A6PELI1 | |
| SCHEMBL22734811 | 0.69 | CYP2A6 (0.52) | CYP2A6CYP2B6CYP2E1PELI1TDO2 | |
| SCHEMBL27734030 | 0.69 | BACE1 (0.50) | CYP2A6 | |
| SCHEMBL4946960 | 0.67 | CYP2A6 (0.64) | TMIGD3ADORA2AADORA1CYP2A6CYP2B6 | |
| SCHEMBL9598459 | 0.67 | CYP2A6 (0.33) | CYP2A6CYP2B6CYP2E1TDO2CYP3A4 | |
| SCHEMBL277051 | 0.67 | PELI1 (0.50) | TMIGD3ADORA2AADORA1CYP2A6CYP2B6 | |
| SCHEMBL28445787 | 0.67 | KCNH2 (0.43) | ADORA2AADORA1CYP2A6CYP2B6CYP2E1 | |
| SCHEMBL6763494 | 0.67 | ERN1 (0.44) | TMIGD3ADORA2AADORA1CYP2A6CYP2B6 | |
| SCHEMBL29431673 | 0.67 | TMIGD3 (0.48) | TMIGD3ADORA2AADORA1CYP2A6PELI1 |
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-6063815-A | TREATMENT OF METABOLIC DISORDERS | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-05-16 | — | — | US | disclosed |