Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.59 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.53 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
| ▸ | PPARG | P37231 | 4/20 | 0.50 |
| ▸ | PPARA | Q07869 | 4/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL607372 | 0.94 | CYP1A2 (0.65) | EPHX2CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL2399722 | 0.94 | CYP1A2 (0.65) | EPHX2CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL117259 | 0.94 | CYP1A2 (0.65) | EPHX2CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL20591019 | 0.93 | CYP1A2 (0.62) | EPHX2CYP1A2CYP2C9CYP2C19GAA | |
| Ammonia Solution, Strong SCHEMBL28260028 | 0.93 | CYP1A2 (0.62) | EPHX2CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL27765434 | 0.93 | CYP1A2 (0.62) | EPHX2CYP1A2CYP2C9CYP2C19GAA | |
| Hydrochloric Acid SCHEMBL11632943 | 0.93 | CYP1A2 (0.62) | EPHX2CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL3217144 | 0.89 | CYP1A2 (0.59) | EPHX2CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL135587 | 0.89 | CYP1A2 (0.59) | EPHX2CYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL27799921 | 0.89 | CYP1A2 (0.69) | EPHX2CYP1A2CYP2C9CYP2C19GAA |
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-111903705-A | Compound herbicide and application thereof | 浙江瑞丰生物科技有限公司 | 2020-11-10 | — | — | CN | claimed |