Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 14/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.36 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.36 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.36 |
| ▸ | ITGAV | P06756 | 1/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.36 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.36 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.36 |
| ▸ | ITGAL | P20701 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | PYGL | P06737 | 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 | |
|---|---|---|---|---|
| SCHEMBL17396985 | 1.00 | AKR1B1 (0.44) | AKR1B1ITGB3ITGB2ITGB1ITGAV | |
| SCHEMBL17396988 | 0.83 | AKR1B1 (0.41) | AKR1B1ITGB3ITGB2ITGB1ITGAV | |
| SCHEMBL17396998 | 0.83 | AKR1B1 (0.41) | AKR1B1ITGB3ITGB2ITGB1ITGAV | |
| SCHEMBL17396984 | 0.83 | AKR1B1 (0.44) | AKR1B1ITGB3ITGB2ITGB1ITGAV | |
| SCHEMBL27450456 | 0.72 | ITGB3 (0.46) | AKR1B1ITGB3ITGB2ITGB1ITGAV | |
| SCHEMBL17363926 | 0.69 | AKR1B1 (0.41) | AKR1B1ITGB3ITGB2ITGB1ITGAV | |
| SCHEMBL17363798 | 0.69 | AKR1B1 (0.41) | AKR1B1ITGB3ITGB2ITGB1ITGAV | |
| SCHEMBL17363916 | 0.69 | AKR1B1 (0.41) | AKR1B1ITGB3ITGB2ITGB1ITGAV | |
| SCHEMBL22344890 | 0.68 | SLC6A4 (0.46) | ITGB3ITGA2BACHE | |
| SCHEMBL7295833 | 0.67 | AKR1B1 (0.44) | AKR1B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3160948-B1 | BENZOXAZINONE AMIDES AS MINERALOCORTICOID RECEPTOR MODULATORS | ASTRAZENECA AB (SE) | 2018-10-24 | — | — | EP | disclosed |