Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 3/20 | 0.48 |
| ▸ | HTR1A | P08908 | 2/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6221872 | 0.88 | CHRM3 (0.58) | ADRA1AHTR1AADRA1DADRA1BCHRM3 | |
| SCHEMBL6969668 | 0.80 | CCR8 (0.55) | ADRA1AHTR1AADRA1DADRA1BKDM4E | |
| SCHEMBL6214270 | 0.78 | KCNH2 (0.51) | KCNH2 | |
| SCHEMBL6976945 | 0.77 | HTR4 (0.57) | HTR1AKCNH2 | |
| SCHEMBL6221055 | 0.77 | HTR4 (0.41) | HTR1AALDH1A1KDM4EDRD3KCNH2 | |
| SCHEMBL6977618 | 0.75 | HTR4 (0.46) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL6975733 | 0.75 | HTR4 (0.48) | ADRA1AHTR1AADRA1DADRA1BKCNH2 | |
| SCHEMBL6628061 | 0.74 | HTR1A (0.54) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL6978353 | 0.74 | ADRB3 (0.46) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL6973562 | 0.73 | HTR4 (0.46) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 |
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 1 patent. 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 | claimed |