Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | TGM2 | P21980 | 1/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | CLK1 | P49759 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20984278 | 0.85 | GAA (0.61) | GAATGM2SMN1; SMN2IDO1P2RX1 | |
| SCHEMBL18707358 | 0.83 | GAA (0.50) | GAATGM2SMN1; SMN2IDO1P2RX1 | |
| SCHEMBL3584581 | 0.81 | MAPT (0.64) | GAASMN1; SMN2IDO1MEN1KMT2A | |
| SCHEMBL28032785 | 0.81 | CYP3A4 (0.60) | GAATGM2SMN1; SMN2IDO1P2RX1 | |
| SCHEMBL167814 | 0.81 | GAA (0.61) | GAATGM2PARP1SMN1; SMN2IDO1 | |
| SCHEMBL26105067 | 0.81 | ALDH1A1 (0.53) | GAAPARP1SMN1; SMN2MMP2MEN1 | |
| SCHEMBL5691420 | 0.79 | DDX3X (0.58) | GAASMN1; SMN2CA1CA14MEN1 | |
| SCHEMBL5253044 | 0.78 | P2RX7 (0.54) | GAAPARP1IDO1MMP2CA14 | |
| SCHEMBL7585259 | 0.78 | MAPT (0.69) | GAATGM2PARP1SMN1; SMN2MEN1 | |
| SCHEMBL9795606 | 0.78 | GAA (0.73) | GAAPARP1SMN1; SMN2MEN1KMT2A |
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-3894398-A1 | 3,3-DIFLUOROALLYLAMINES OR SALTS THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | Yuhan Corporation (KR) | 2021-10-20 | — | — | EP | disclosed |
| WO-2020121261-A1 | 3,3-DIFLUOROALLYLAMINES OR SALTS THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | YUHAN CORPORATION (KR) | 2020-06-18 | — | — | WO | disclosed |