Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | LPL | P06858 | 4/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 4/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | EGLN2 | Q96KS0 | 4/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | TDP2 | O95551 | 2/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | TDO2 | P48775 | 1/20 | 0.30 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2648760 | 0.90 | LPL (0.43) | EGFRLPLLIPGESR2ROCK1 | |
| SCHEMBL4006930 | 0.89 | LPL (0.40) | EGFRLPLLIPGESR2CYP11B1 | |
| SCHEMBL20794283 | 0.86 | LPL (0.40) | EGFRLPLLIPGESR2CYP11B1 | |
| SCHEMBL20794291 | 0.82 | LPL (0.43) | EGFRLPLLIPGESR2CYP11B1 | |
| SCHEMBL6216928 | 0.81 | LPL (0.38) | EGFRLPLLIPGESR2PDGFRB | |
| SCHEMBL2659727 | 0.78 | LPL (0.46) | EGFRLPLLIPGESR2ROCK1 | |
| SCHEMBL4007982 | 0.77 | CYP11B2 (0.43) | EGFRLPLLIPGESR2CYP11B1 | |
| SCHEMBL15810291 | 0.77 | LPL (0.48) | EGFRLPLLIPGESR2PDGFRB | |
| SCHEMBL2650626 | 0.76 | LPL (0.41) | EGFRLPLLIPGESR2CYP11B1 | |
| SCHEMBL31463159 | 0.75 | LIPG (0.45) | LPLLIPGESR2CYP11B2PDGFRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004041826-A1 | IMIDAZOPYRAZINONES AND IMIDAZOTRIAZINONES DERIVATES AS GABA-A RECEPTOR ANXIOLYTIC | MERCK SHARP & DOHME LIMITED (GB) | 2004-05-21 | — | — | WO | disclosed |