Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 2/20 | 0.50 |
| ▸ | CCR8 | P51685 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7548762 | 1.00 | SLC2A1 (0.50) | SLC2A1CCR8KCNH2CYP2D6KDM4E | |
| SCHEMBL7547104 | 0.88 | SLC2A1 (0.52) | SLC2A1CCR8KCNH2 | |
| SCHEMBL5852476 | 0.86 | SLC2A1 (0.58) | SLC2A1CCR8KCNH2CYP2D6KDM4E | |
| SCHEMBL5853742 | 0.86 | SLC2A1 (0.58) | SLC2A1CCR8KCNH2CYP2D6KDM4E | |
| Trifluoroacetic Acid SCHEMBL7498961 | 0.85 | KCNH2 (0.49) | SLC2A1KCNH2 | |
| SCHEMBL6969140 | 0.83 | KCNH2 (0.55) | SLC2A1CCR8KCNH2 | |
| SCHEMBL6969141 | 0.83 | KCNH2 (0.55) | SLC2A1CCR8KCNH2 | |
| SCHEMBL6971989 | 0.82 | KCNH2 (0.56) | SLC2A1KCNH2CYP2D6KDM4EALDH1A1 | |
| SCHEMBL6971999 | 0.82 | KCNH2 (0.56) | SLC2A1KCNH2CYP2D6KDM4EALDH1A1 | |
| SCHEMBL6971995 | 0.82 | KCNH2 (0.56) | SLC2A1KCNH2CYP2D6KDM4EALDH1A1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6989447-B2 | Compounds | SMITHKLINE BEECHAM P.L.C. (GB) | 2006-01-24 | — | — | US | claimed |
| US-20040116452-A1 | Compounds | SMITHKLINE BEECHAM P.I.C. | 2004-06-17 | — | — | US | claimed |
| EP-1202987-B1 | QUINOLINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2003-11-26 | — | — | EP | claimed |
| EP-1202987-A2 | QUINOLINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2002-05-08 | — | — | EP | claimed |
| WO-2001007433-A2 | QUINOLINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM P.L.C. (GB) | 2001-02-01 | — | — | WO | claimed |
| US-6989447-B2 | Compounds | SMITHKLINE BEECHAM P.L.C. (GB) | 2006-01-24 | — | — | US | disclosed |
| US-20040116452-A1 | Compounds | SMITHKLINE BEECHAM P.I.C. | 2004-06-17 | — | — | US | disclosed |
| EP-1202987-B1 | QUINOLINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2003-11-26 | — | — | EP | disclosed |