Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SLC6A1 | P30531 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18082563 | 0.84 | BCHE (0.38) | KDM4EBCHEHRH3 | |
| SCHEMBL30411713 | 0.83 | ACHE (0.42) | BCHE | |
| SCHEMBL12713 | 0.83 | BCHE (0.43) | BCHEALDH1A1 | |
| SCHEMBL20233050 | 0.83 | BCHE (0.43) | BCHEALDH1A1 | |
| SCHEMBL13036991 | 0.83 | BCHE (0.43) | BCHEALDH1A1 | |
| SCHEMBL17277607 | 0.81 | KDM4E (0.55) | KDM4EALDH1A1LMNAHRH3SMN1; SMN2 | |
| SCHEMBL24461460 | 0.80 | BCHE (0.41) | KDM4EBCHEALDH1A1LMNA | |
| SCHEMBL15223935 | 0.80 | HTR1A (0.43) | KDM4EHTR1ATSHRALDH1A1LMNA | |
| SCHEMBL12424240 | 0.80 | BCHE (0.41) | KDM4EBCHEALDH1A1LMNA | |
| SCHEMBL3234907 | 0.77 | MAPT (0.42) | KDM4EHRH3CYP2D6 |
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-9193731-B2 | Antimicrobial compounds and methods of making and using the same | MELINTA THERAPEUTICS, INC. (US) | 2015-11-24 | — | — | US | disclosed |