Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.70 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.64 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.64 |
| ▸ | RXFP1 | Q9HBX9 | 7/20 | 0.62 |
| ▸ | TP53 | P04637 | 3/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL1060801 | 0.90 | CYP1A2 (0.72) | CYP1A2CYP3A4RXFP1TP53MAPK1 | |
| SCHEMBL18166736 | 0.90 | CYP1A2 (0.72) | CYP1A2CYP3A4RXFP1TP53MAPK1 | |
| SCHEMBL18166737 | 0.89 | CYP1A2 (0.71) | CYP1A2CYP3A4RXFP1TP53MAPK1 | |
| SCHEMBL1066761 | 0.89 | CYP1A2 (0.71) | CYP1A2CYP3A4RXFP1TP53MAPK1 | |
| SCHEMBL18166663 | 0.89 | CYP1A2 (0.71) | CYP1A2CYP3A4RXFP1TP53MAPK1 | |
| SCHEMBL20161764 | 0.89 | CYP1A2 (0.71) | CYP1A2CYP3A4RXFP1TP53MAPK1 | |
| SCHEMBL1065336 | 0.87 | CYP1A2 (0.78) | CYP1A2CYP3A4RXFP1TP53MAPK1 | |
| SCHEMBL1066585 | 0.87 | CYP1A2 (0.69) | CYP1A2CYP3A4RXFP1TP53MAPK1 | |
| SCHEMBL18166590 | 0.87 | CYP1A2 (0.69) | CYP1A2CYP3A4RXFP1TP53MAPK1 | |
| SCHEMBL10114294 | 0.86 | RXFP1 (0.68) | CYP1A2CYP3A4ABCC8KCNJ11RXFP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3663295-A1 | 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL | ELI LILLY AND CO. (US) | 2020-06-10 | — | — | EP | disclosed |
| EP-3184527-A1 | 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL | Hydra Biosciences, Inc. (US) | 2017-06-28 | — | — | EP | disclosed |
| EP-2170309-B1 | 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL | HYDRA BIOSCIENCES INC (US) | 2016-10-26 | — | — | EP | disclosed |