Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.51 |
| ▸ | NCF1 | P14598 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.41 |
| ▸ | CLK2 | P49760 | 1/20 | 0.41 |
| ▸ | CLK3 | P49761 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | DYRK4 | Q9NR20 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6977344 | 1.00 | ROCK2 (0.51) | ROCK2NCF1MTNR1AMTNR1BKCNH2 | |
| SCHEMBL6977351 | 1.00 | ROCK2 (0.51) | ROCK2NCF1MTNR1AMTNR1BKCNH2 | |
| SCHEMBL6971430 | 0.83 | NCF1 (0.49) | NCF1KCNH2TDP1KDM4ECYP2D6 | |
| SCHEMBL6971434 | 0.83 | NCF1 (0.49) | NCF1KCNH2TDP1KDM4ECYP2D6 | |
| SCHEMBL6971431 | 0.83 | NCF1 (0.49) | NCF1KCNH2TDP1KDM4ECYP2D6 | |
| SCHEMBL10953793 | 0.81 | KCNH2 (0.59) | NCF1MTNR1AMTNR1BKCNH2 | |
| Hydrochloric Acid SCHEMBL10953152 | 0.80 | KCNH2 (0.58) | NCF1MTNR1AMTNR1BKCNH2TDP1 | |
| SCHEMBL6977177 | 0.80 | CCR8 (0.53) | ROCK2MTNR1AMTNR1BKCNH2KDM4E | |
| SCHEMBL6977170 | 0.80 | CCR8 (0.53) | ROCK2MTNR1AMTNR1BKCNH2KDM4E | |
| SCHEMBL6977174 | 0.80 | CCR8 (0.53) | ROCK2MTNR1AMTNR1BKCNH2KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1051413-B1 | QUINOLINE DERIVATIVES AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2003-06-04 | — | — | EP | disclosed |
| EP-1051413-A1 | QUINOLINE DERIVATIVES AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2000-11-15 | — | — | EP | disclosed |
| WO-1999037635-A1 | QUINOLINE DERIVATIVES AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 1999-07-29 | — | — | WO | disclosed |