Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2190749 | 0.84 | CYP1A1 (0.36) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL1978513 | 0.76 | TTR (0.32) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL8005775 | 0.74 | GRM5 (0.42) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL17046357 | 0.73 | — | — | |
| SCHEMBL26652 | 0.69 | — | — | |
| SCHEMBL28178974 | 0.68 | CES2 (0.33) | — | |
| SCHEMBL27731111 | 0.67 | — | — | |
| SCHEMBL27614113 | 0.67 | — | — | |
| SCHEMBL27737828 | 0.67 | — | — | |
| SCHEMBL935880 | 0.67 | CA12 (0.50) | CYP1A1CYP1A2CYP1B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011072064-A1 | S PIRO [CHROMAN - 4, 4 ' - IMIDAZOL] ONES AS BETA - SECRETASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2011-06-16 | — | — | WO | claimed |
| WO-2011072064-A1 | S PIRO [CHROMAN - 4, 4 ' - IMIDAZOL] ONES AS BETA - SECRETASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2011-06-16 | — | — | WO | disclosed |