Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 13/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MGLL | Q99685 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | PKLR | P30613 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL25301386 | 0.88 | MGLL (0.57) | MGLLALDH1A1PKML3MBTL1 | |
| SCHEMBL14834444 | 0.86 | MGLL (0.67) | TGFBR1MGLL | |
| SCHEMBL27900249 | 0.86 | TGFBR1 (0.65) | TGFBR1SMN1; SMN2ALDH1A1PKMKDM4E | |
| SCHEMBL27917828 | 0.84 | TGFBR1 (0.59) | TGFBR1SMN1; SMN2ALDH1A1PKMHDAC3 | |
| SCHEMBL27917924 | 0.81 | ALDH1A1 (0.70) | TGFBR1SMN1; SMN2ALDH1A1PKMHDAC3 | |
| SCHEMBL1808102 | 0.80 | CACNA1B (0.48) | MGLLPKLR | |
| SCHEMBL27900131 | 0.80 | FBP1 (0.57) | TGFBR1SMN1; SMN2MGLLALDH1A1PKM | |
| SCHEMBL28805529 | 0.79 | CNR1 (0.48) | TGFBR1MGLLALDH1A1PKM | |
| SCHEMBL27917838 | 0.78 | BCHE (0.65) | TGFBR1ALDH1A1PKMHDAC3HDAC4 | |
| SCHEMBL27917918 | 0.77 | MGLL (0.51) | TGFBR1SMN1; SMN2MGLLALDH1A1PKM |
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 |
|---|---|---|---|---|---|---|---|
| CN-103068797-A | Hexafluoroisopropyl carbamate derivatives, their preparation and their therapeutic application | SANOFI SA | 2013-04-24 | — | — | CN | disclosed |