Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAE1 | Q13564 | 4/20 | 0.49 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.49 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.49 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | HTR2B | P41595 | 2/20 | 0.49 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | MLNR | O43193 | 1/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | PGR | P06401 | 1/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6849453 | 0.86 | AGTR1 (0.64) | AGTR2AGTR1CYP3A4ADORA3ADRA2B | |
| SCHEMBL967294 | 0.84 | AGTR2 (0.66) | NAE1AGTR2AGTR1CYP3A4ADORA3 | |
| SCHEMBL3029695 | 0.81 | AGTR2 (0.69) | NAE1AGTR2AGTR1CYP3A4ADORA3 | |
| SCHEMBL969721 | 0.73 | AGTR2 (0.66) | NAE1AGTR2AGTR1CYP3A4ADORA3 | |
| SCHEMBL3977106 | 0.71 | AGTR2 (0.62) | NAE1AGTR2AGTR1CYP3A4ADORA3 | |
| SCHEMBL18087852 | 0.70 | AGTR2 (0.63) | NAE1AGTR2AGTR1CYP3A4ADORA3 | |
| SCHEMBL3975959 | 0.69 | AGTR1 (0.75) | AGTR2AGTR1CYP3A4ADORA3ADRA2B | |
| SCHEMBL7017670 | 0.69 | AGTR2 (0.59) | NAE1AGTR2AGTR1CYP3A4ADORA3 | |
| SCHEMBL683298 | 0.69 | AGTR2 (0.62) | NAE1AGTR2AGTR1CYP3A4ADORA3 | |
| SCHEMBL1653406 | 0.69 | AGTR2 (0.62) | NAE1AGTR2AGTR1CYP3A4ADORA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1718641-A2 | BENZIMIDAZOLE DERIVATIVE AND ITS USE AS AII RECEPTOR ANTAGONIST | Takeda Pharmaceutical Company Limited (JP) | 2006-11-08 | — | — | EP | disclosed |
| WO-2005080384-A2 | BENZIMIDAZOLE DERIVATIVE AND USE AS AII RECEPTOR ANTAGONIST | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2005-09-01 | — | — | WO | disclosed |