Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | ING2 | Q9H160 | 1/20 | 0.32 |
| ▸ | NT5E | P21589 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CASP6 | P55212 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28616318 | 0.82 | TSHR (0.44) | MRGPRX4NT5EALDH1A1TSHRHSD17B10 | |
| SCHEMBL6536459 | 0.81 | LCK (0.38) | MRGPRX4LCKFYNING2NT5E | |
| SCHEMBL778371 | 0.70 | TSHR (0.47) | NT5EALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL13817650 | 0.70 | LCK (0.41) | MRGPRX4LCKFYNING2NT5E | |
| SCHEMBL28606587 | 0.68 | ACP1 (0.32) | — | |
| SCHEMBL3915839 | 0.68 | LCK (0.43) | LCKFYNING2NT5EALDH1A1 | |
| SCHEMBL18289515 | 0.67 | LCK (0.39) | MRGPRX4LCKFYNING2NT5E | |
| SCHEMBL28609841 | 0.67 | GABRA1 (0.31) | ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL11460419 | 0.66 | NT5E (0.42) | LCKFYNING2NT5EALDH1A1 | |
| SCHEMBL212996 | 0.66 | LCK (0.41) | LCKFYNING2NT5EALDH1A1 |
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-113272286-A | Process for preparing 4- (2,2,3, 3-tetrafluoropropyl) morpholine | 阿德弗里奥药品有限责任公司 | 2021-08-17 | — | — | CN | disclosed |