Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.53 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | ALB | P02768 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6745256 | 0.80 | LTA4H (0.50) | ADORA2ACTNNB1KMT2ALMNAGAA | |
| SCHEMBL21796059 | 0.78 | ADORA2A (0.55) | ADORA2ACTNNB1KMT2ALMNAGAA | |
| SCHEMBL31305020 | 0.77 | GAA (0.52) | ADORA2ACTNNB1KMT2ALMNAGAA | |
| SCHEMBL113777 | 0.77 | GAA (0.52) | ADORA2ACTNNB1KMT2ALMNAGAA | |
| SCHEMBL11449754 | 0.75 | CTNNB1 (0.48) | CTNNB1KMT2ALMNAGAATSHR | |
| SCHEMBL11447548 | 0.75 | GAA (0.50) | ADORA2ACTNNB1KMT2ALMNAGAA | |
| SCHEMBL6681917 | 0.75 | ADORA2A (0.53) | ADORA2ACTNNB1KMT2ALMNAGAA | |
| Water SCHEMBL5145621 | 0.75 | GAA (0.50) | ADORA2ACTNNB1KMT2ALMNAGAA | |
| SCHEMBL11447558 | 0.74 | ALDH1A1 (0.54) | ADORA2AKMT2AGAATSHRNCOA1 | |
| SCHEMBL51822 | 0.74 | LTA4H (0.69) | CTNNB1KMT2ALMNAGAAMAOA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4183955-A | Troponyl-oxamic acid derivatives for treating allergic conditions | Ayerst. McKenna & Harrison Limited (CA) | 1980-01-15 | — | — | US | disclosed |
| US-4125625-A | ANTIALLERGENS | AYERST, MCKENNA & HARRISON LIMITED (CA) | 1978-11-14 | — | — | US | disclosed |
| US-4057556-A | ANTIALLERGENS | AYERST, MCKENNA & HARRISON LTD. (CA) | 1977-11-08 | — | — | US | disclosed |