Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD2 | Q9NRG4 | 3/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 2/20 | 0.31 |
| ▸ | GRM1 | Q13255 | 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 | |
|---|---|---|---|---|
| SCHEMBL611104 | 0.74 | SMYD2 (0.34) | SMYD2CYP3A4HTTSMN1; SMN2ABL1 | |
| SCHEMBL20640566 | 0.73 | SMYD2 (0.37) | SMYD2CYP3A4HTTSMN1; SMN2ABL1 | |
| SCHEMBL19615476 | 0.73 | SMN1; SMN2 (0.38) | SMYD2ATMCYP3A4HTTSMN1; SMN2 | |
| SCHEMBL23043359 | 0.72 | SMYD2 (0.36) | SMYD2CYP3A4HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL2907725 | 0.71 | SMYD2 (0.37) | SMYD2CYP3A4HTTSMN1; SMN2ABL1 | |
| SCHEMBL30563837 | 0.71 | DGAT1 (0.38) | SMYD2CYP3A4HTTSMN1; SMN2ABL1 | |
| SCHEMBL187156 | 0.71 | SMYD2 (0.37) | SMYD2CYP3A4HTTSMN1; SMN2ABL1 | |
| SCHEMBL4126826 | 0.70 | DGAT1 (0.38) | SMYD2CYP3A4HTTSMN1; SMN2ABL1 | |
| SCHEMBL28887797 | 0.70 | CYP4A11 (0.39) | SMYD2CYP3A4HTTSMN1; SMN2ABL1 | |
| SCHEMBL22070853 | 0.70 | CHRM1 (0.42) | SMYD2CYP3A4HTTSMN1; SMN2ABL1 |
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-111163774-A | Bacterial efflux pump inhibitors | 罗格斯新泽西州立大学 | 2020-05-15 | — | — | CN | disclosed |