Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.40 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.40 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | GSR | P00390 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28778207 | 1.00 | CYP1A2 (0.45) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL10368365 | 0.79 | KDM4E (0.48) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL3976739 | 0.71 | KDM4E (0.61) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL20155597 | 0.69 | GSR (0.48) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL19411274 | 0.67 | KDM4E (0.44) | CYP1A2CYP2C19MAPTALDH1A1KDM4E | |
| SCHEMBL22285879 | 0.67 | KDM4E (0.44) | CYP1A2CYP2C19MAPTALDH1A1KDM4E | |
| SCHEMBL3979892 | 0.66 | MAPT (0.55) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL7641949 | 0.66 | SLC9A1 (0.57) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL9704918 | 0.65 | MAPK1 (0.50) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL3976738 | 0.64 | KDM4E (0.65) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 |
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-114685384-B | Difluoromethyl reaction method and application thereof | 深圳大学 | 2023-07-14 | — | — | CN | disclosed |
| CN-114685384-A | Difluoromethyl reaction method and application thereof | 深圳大学 | 2022-07-01 | — | — | CN | disclosed |