Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 4/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3299399 | 0.93 | NFKB1 (0.42) | NFKB1NFKB2RELAKMT2AALDH1A1 | |
| SCHEMBL10413343 | 0.73 | NFKB1 (0.49) | NFKB1NFKB2RELAKMT2AALDH1A1 | |
| SCHEMBL3295361 | 0.73 | NFKB1 (0.34) | NFKB1NFKB2RELAKMT2AALDH1A1 | |
| SCHEMBL23142325 | 0.72 | NFKB1 (0.48) | NFKB1NFKB2RELAKMT2AL3MBTL1 | |
| SCHEMBL6644022 | 0.71 | KMT2A (0.33) | NFKB1NFKB2RELAKMT2AALDH1A1 | |
| SCHEMBL25608427 | 0.71 | NFKB1 (0.50) | NFKB1NFKB2RELAKMT2AL3MBTL1 | |
| SCHEMBL23142326 | 0.71 | NFKB1 (0.47) | NFKB1NFKB2RELAKMT2AL3MBTL1 | |
| SCHEMBL6283764 | 0.69 | NFKB1 (0.40) | NFKB1NFKB2RELAKMT2AALDH1A1 | |
| SCHEMBL6283768 | 0.68 | NFKB1 (0.38) | NFKB1NFKB2RELAKMT2AALDH1A1 | |
| SCHEMBL17467812 | 0.67 | NFKB1 (0.48) | NFKB1NFKB2RELAKMT2AALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5412098-A | Quinolone derivative or salt thereof and antibacterial containing the same | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1995-05-02 | — | — | US | disclosed |
| EP-0596126-A1 | NOVEL QUINOLONE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1994-05-11 | — | — | EP | disclosed |