Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPFFR1 | Q9GZQ6 | 2/20 | 0.39 |
| ▸ | NPFFR2 | Q9Y5X5 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 8/20 | 0.39 |
| ▸ | CA1 | P00915 | 5/20 | 0.39 |
| ▸ | THRB | P10828 | 7/20 | 0.38 |
| ▸ | THRA | P10827 | 5/20 | 0.38 |
| ▸ | KLK7 | P49862 | 1/20 | 0.35 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7141370 | 0.79 | NPFFR1 (0.40) | NPFFR1NPFFR2CA2CA1KLK7 | |
| SCHEMBL7093257 | 0.77 | MAPT (0.39) | CA2CA1CA9CA12MEN1 | |
| SCHEMBL7093258 | 0.77 | MAPT (0.39) | CA2CA1CA9CA12MEN1 | |
| SCHEMBL7091866 | 0.77 | CA1 (0.42) | NPFFR1NPFFR2CA2CA1THRB | |
| SCHEMBL7091722 | 0.73 | CA2 (0.48) | CA2CA1CA9CA12MEN1 | |
| SCHEMBL7091721 | 0.73 | CA2 (0.48) | CA2CA1CA9CA12MEN1 | |
| SCHEMBL7093259 | 0.71 | LTA4H (0.43) | CA2CA1CA9CA12KDM4E | |
| SCHEMBL7089757 | 0.67 | CA2 (0.44) | CA2CA1CA9CA12 | |
| SCHEMBL7089756 | 0.67 | CA2 (0.44) | CA2CA1CA9CA12 | |
| SCHEMBL7093260 | 0.66 | CA2 (0.35) | CA2CA1CA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003087127-A2 | ANTIMICROBIAL COMPOUNDS AGAINST STAPHYLOCOCCI, MYCOBACTERIA, AND OTHER INFECTIOUS AGENTS | EXEGENICS INC. (US) | 2003-10-23 | — | — | WO | disclosed |