Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | ADH5 | P11766 | 2/20 | 0.45 |
| ▸ | GSK3B | P49841 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | MARS1 | P56192 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | AKT2 | P31751 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | PRKX | P51817 | 1/20 | 0.40 |
| ▸ | NEK4 | P51957 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10966713 | 0.83 | AKR1C3 (0.49) | ADH5GSK3BMAPK1RPS6KA5MAP4K4 | |
| SCHEMBL10965375 | 0.78 | GSK3B (0.55) | ALDH1A1GSK3BMAPK1ROCK2RPS6KA5 | |
| SCHEMBL10376117 | 0.75 | ALDH1A1 (0.38) | ALDH1A1KDM4EAGTR1GSK3BMEN1 | |
| SCHEMBL8589404 | 0.75 | GSTO1 (0.50) | ALDH1A1KDM4EMEN1KMT2AMAPK1 | |
| SCHEMBL5005689 | 0.74 | GSK3B (0.59) | ALDH1A1GSK3BSRD5A2MAPK1KMO | |
| SCHEMBL29836035 | 0.74 | GSK3B (0.59) | ALDH1A1GSK3BSRD5A2MAPK1KMO | |
| SCHEMBL10585776 | 0.73 | ALDH1A1 (0.60) | ALDH1A1KDM4EGSK3BMEN1KMT2A | |
| SCHEMBL10170998 | 0.72 | GSK3B (0.56) | ALDH1A1KDM4EGSK3BMAPK1TRPA1 | |
| Hydrochloric Acid SCHEMBL4898869 | 0.72 | ALDH1A1 (0.58) | ALDH1A1KDM4EGSK3BMEN1KMT2A | |
| SCHEMBL8768769 | 0.71 | GSK3B (0.55) | ALDH1A1KDM4EGSK3BMAPK1KMO |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0162333-B1 | QUINO-BENZOTHIAZINE ANTIBACTERIAL COMPOUNDS | ABBOTT LABORATORIES (US) | 1990-06-27 | — | — | EP | disclosed |
| EP-0162333-A1 | Quino-benzothiazine antibacterial compounds | ABBOTT LABORATORIES (US) | 1985-11-27 | — | — | EP | disclosed |
| US-4540694-A | 1-Pyridine substituted quino-benoxazines and antibacterial use | ABBOTT LABORATORIES (US) | 1985-09-10 | — | — | US | disclosed |
| US-4529725-A | 1-Pyridine substituted quino-benzothiazine | ABBOTT LABORATORIES (US) | 1985-07-16 | — | — | US | disclosed |