Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | AKT1 | P31749 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 5/20 | 0.41 |
| ▸ | CTSL | P07711 | 3/20 | 0.41 |
| ▸ | CTSB | P07858 | 3/20 | 0.41 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27903264 | 0.82 | CA12 (0.51) | CA12CA1CA7CA14AKT1 | |
| SCHEMBL27903265 | 0.82 | CA12 (0.51) | CA12CA1CA7CA14AKT1 | |
| SCHEMBL27903266 | 0.82 | CA12 (0.51) | CA12CA1CA7CA14AKT1 | |
| SCHEMBL11586767 | 0.82 | CA12 (0.46) | CA12CA1CA7CA14AKT1 | |
| SCHEMBL7521815 | 0.82 | CA12 (0.46) | CA12CA1CA7CA14AKT1 | |
| SCHEMBL6342235 | 0.81 | SIGMAR1 (0.50) | CA12CA1CA7CA14ALDH1A1 | |
| SCHEMBL14266632 | 0.80 | ALDH1A1 (0.58) | CA12CA1CA7CA14AKT1 | |
| SCHEMBL9150280 | 0.80 | CYP2C19 (0.45) | CA12CA1CA7CA14AKT1 | |
| SCHEMBL3425341 | 0.79 | CA12 (0.49) | CA12CA1CA7CA14AKT1 | |
| SCHEMBL22059597 | 0.79 | CA12 (0.49) | CA12CA1CA7CA14AKT1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105732581-A | CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS IV | ABBVIE 公司 | 2016-07-06 | — | — | CN | disclosed |
| CN-102753541-A | Carboxamide compounds and their use as calpain inhibitors iv | ABBOTT GMBH & CO KG | 2012-10-24 | — | — | CN | disclosed |