Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL24676843 | 0.75 | S1PR5 (0.38) | — | |
| SCHEMBL8948684 | 0.74 | SMN1; SMN2 (0.34) | TDP1 | |
| SCHEMBL19724362 | 0.72 | LTA4H (0.31) | — | |
| SCHEMBL570862 | 0.71 | NR1H2 (0.47) | ALDH1A1 | |
| SCHEMBL8948644 | 0.71 | ATM (0.41) | — | |
| SCHEMBL26856777 | 0.67 | NR1H2 (0.30) | — | |
| SCHEMBL24654380 | 0.66 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL25351419 | 0.66 | LMNA (0.45) | KDM4E | |
| SCHEMBL18403339 | 0.65 | MEN1 (0.49) | ALDH1A1 | |
| SCHEMBL2317708 | 0.65 | SLC6A1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9688711-B2 | Antibacterial aminoglycoside analogs | ACHAOGEN, INC. (US) | 2017-06-27 | — | — | US | disclosed |