Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2945463 | 0.81 | KCNH2 (0.44) | KCNH2SLC2A1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL13238463 | 0.77 | DRD2 (0.52) | KCNH2KDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL2952599 | 0.76 | KCNH2 (0.42) | KCNH2SLC2A1 | |
| SCHEMBL17844920 | 0.76 | KCNH2 (0.48) | KCNH2SLC2A1 | |
| SCHEMBL5548608 | 0.74 | CYP8B1 (0.37) | KCNH2SLC2A1 | |
| SCHEMBL17861460 | 0.72 | CKS1B (0.48) | KCNH2SLC2A1 | |
| SCHEMBL1224674 | 0.71 | CHRNB2 (0.45) | KCNH2ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL3632714 | 0.70 | MAPT (0.42) | KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5260306 | 0.70 | KCNH2 (0.51) | KCNH2SLC2A1 | |
| SCHEMBL1222889 | 0.70 | DPP4 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1846411-A2 | ANTIBACTERIAL AGENTS | GLAXO GROUP LIMITED (GB) | 2007-10-24 | — | — | EP | disclosed |
| WO-2006081289-A2 | ANTIBACTERIAL AGENTS | GLAXO GROUP LIMITED (GB) | 2006-08-03 | — | — | WO | disclosed |