Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR7 | P34969 | 2/20 | 0.37 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5514755 | 0.86 | ALDH1A1 (0.39) | ALDH1A1CYP1A2HSD17B10ALOX15CYP11B1 | |
| SCHEMBL4869521 | 0.79 | PDE10A (0.46) | CYP2D6CYP3A4CYP2C19CYP2E1CYP2A6 | |
| SCHEMBL7030913 | 0.78 | TLR8 (0.41) | ALDH1A1CYP1A2HSD17B10CYP11B1CYP11B2 | |
| SCHEMBL4871159 | 0.78 | CYP2E1 (0.41) | CYP11B1CYP11B2CYP2D6CYP3A4CYP2C19 | |
| SCHEMBL5924494 | 0.77 | PDE10A (0.47) | KDM5BCYP2D6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL6421708 | 0.77 | TLR8 (0.42) | ALDH1A1KDM5B | |
| SCHEMBL8086790 | 0.77 | MAPK13 (0.42) | CYP11B1CYP11B2KDM5B | |
| SCHEMBL4172725 | 0.75 | HPGDS (0.38) | CYP2D6CYP3A4CYP2C19CYP2E1CYP2A6 | |
| SCHEMBL4870581 | 0.75 | CYP2E1 (0.41) | CYP11B1CYP2D6CYP3A4CYP2C19CYP2E1 | |
| SCHEMBL5821644 | 0.74 | CYP11B1 (0.41) | ALDH1A1CYP11B1CYP11B2CYP2D6MEN1 |
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-1794171-A2 | KETOLIDE DERIVATIVES AS ANTIBACTERIAL AGENTS | RANBAXY LABORATORIES, LTD. (IN) | 2007-06-13 | — | — | EP | disclosed |
| WO-2006080954-A1 | KETOLIDE DERIVATIVES AS ANTIBACTERIAL AGENTS | RANBAXY LABORATORIES LIMITED (IN) | 2006-08-03 | — | — | WO | disclosed |