Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLCG1 | P19174 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 5/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 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 | |
|---|---|---|---|---|
| SCHEMBL11222461 | 0.88 | PLCG1 (0.52) | PLCG1CA2CA9CA1MMP2 | |
| SCHEMBL13707919 | 0.82 | MAPK1 (0.46) | CA2CA9CA1MMP2CA12 | |
| SCHEMBL11249350 | 0.81 | PLCG1 (0.45) | PLCG1CA2CA9CA1MMP2 | |
| SCHEMBL27649868 | 0.81 | PLCG1 (0.45) | PLCG1CA2CA9CA1MMP2 | |
| SCHEMBL11443510 | 0.81 | TSHR (0.45) | CA2CA9CA1MMP2CA12 | |
| SCHEMBL263231 | 0.81 | GAA (0.45) | CA2CA9CA1CA12GAA | |
| SCHEMBL5745074 | 0.80 | TDP1 (0.44) | CA2CA9CA1CA12CA7 | |
| SCHEMBL6114758 | 0.79 | PLCG1 (0.52) | PLCG1CA2CA9CA1MMP2 | |
| SCHEMBL9182366 | 0.79 | PLCG1 (0.44) | PLCG1CA2CA9CA1MMP2 | |
| SCHEMBL12737576 | 0.79 | GAA (0.46) | PLCG1CA2CA9CA1MMP2 |
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-9617256-B2 | Antibacterial agents | ACHAOGEN, INC. (US) | 2017-04-11 | — | — | US | disclosed |