Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | MMP9 | P14780 | 2/20 | 0.36 |
| ▸ | MMP14 | P50281 | 2/20 | 0.36 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17277617 | 0.85 | FFAR4 (0.48) | CYP3A4L3MBTL1FFAR4BCHEACHE | |
| SCHEMBL12062342 | 0.83 | CYP3A4 (0.39) | CYP3A4L3MBTL1FFAR4SLC6A4SLC6A3 | |
| SCHEMBL12075868 | 0.81 | CYP3A4 (0.42) | CYP3A4L3MBTL1FFAR4CA12CA1 | |
| SCHEMBL17277532 | 0.77 | TP53 (0.36) | CYP3A4FFAR4BCHEACHESLC6A4 | |
| SCHEMBL12075807 | 0.73 | SCN8A (0.41) | L3MBTL1 | |
| SCHEMBL12075491 | 0.72 | KMT2A (0.53) | CYP3A4 | |
| SCHEMBL17365350 | 0.71 | BCHE (0.32) | CYP3A4FFAR4BCHEACHESLC6A4 | |
| SCHEMBL21190211 | 0.71 | TSHR (0.41) | L3MBTL1SLC6A4 | |
| SCHEMBL3684870 | 0.70 | CA12 (0.58) | L3MBTL1FFAR4MMP2MMP9MMP14 | |
| SCHEMBL17277356 | 0.68 | SLC7A5 (0.35) | CA1CA2CA9 |
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 |