Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | TBXAS1 | P24557 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18418134 | 0.94 | CA1 (0.43) | CA1CA2HDAC4HDAC6LMNA | |
| SCHEMBL18418159 | 0.94 | CA1 (0.43) | CA1CA2HDAC4HDAC6LMNA | |
| SCHEMBL19923359 | 0.83 | CA1 (0.50) | CA1CA2HDAC4HDAC6LMNA | |
| SCHEMBL18422360 | 0.83 | CA1 (0.50) | CA1CA2HDAC4HDAC6LMNA | |
| SCHEMBL18422361 | 0.78 | CA1 (0.49) | CA1CA2HDAC4HDAC6LMNA | |
| SCHEMBL18422362 | 0.78 | CA1 (0.49) | CA1CA2HDAC4HDAC6LMNA | |
| SCHEMBL18481403 | 0.76 | CA1 (0.44) | CA1CA2HDAC4HDAC6LMNA | |
| SCHEMBL18418142 | 0.73 | ALDH1A1 (0.41) | CA1CA2HDAC4HDAC6LMNA | |
| SCHEMBL21391904 | 0.73 | ALDH1A1 (0.41) | CA1CA2HDAC4HDAC6LMNA | |
| SCHEMBL18480978 | 0.72 | CA1 (0.54) | CA1CA2HDAC4HDAC6LMNA |
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-3328849-B9 | 1,1,1-TRIFLUORO-3-HYDROXYPROPAN-2-YL CARBAMATE DERIVATIVES AND 1,1,1-TRIFLUORO-4-HYDROXYBUTAN-2-YL CARBAMATE DERIVATIVES AS MAGL INHIBITORS | PFIZER (US) | 2021-01-06 | — | — | EP | disclosed |
| EP-3328849-B1 | 1,1,1-TRIFLUORO-3-HYDROXYPROPAN-2-YL CARBAMATE DERIVATIVES AND 1,1,1-TRIFLUORO-4-HYDROXYBUTAN-2-YL CARBAMATE DERIVATIVES AS MAGL INHIBITORS | PFIZER (US) | 2020-09-09 | — | — | EP | disclosed |