Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 5/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.43 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | HCK | P08631 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.39 |
| ▸ | PRKDC | P78527 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18003520 | 0.81 | PIK3CA (0.50) | ERN1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL14968263 | 0.81 | ERN1 (0.43) | ERN1CYP11B2CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL29828302 | 0.79 | ERN1 (0.46) | ERN1ESR1ESR2 | |
| SCHEMBL21199864 | 0.77 | ERN1 (0.45) | ERN1CYP11B2CYP11B1ESR1ESR2 | |
| SCHEMBL4735387 | 0.76 | ERN1 (0.51) | ERN1MAPT | |
| SCHEMBL17832843 | 0.76 | ERN1 (0.40) | ERN1PIK3CDABL1EGFRHCK | |
| SCHEMBL2774294 | 0.76 | KIF11 (0.44) | ERN1ESR1ESR2MAPT | |
| SCHEMBL15903722 | 0.76 | ALDH1A1 (0.35) | — | |
| SCHEMBL23905206 | 0.75 | ERN1 (0.52) | ERN1EGFRPIK3CAPIK3CG | |
| SCHEMBL15645548 | 0.75 | ERN1 (0.46) | ERN1CYP11B2CYP2E1CYP2A6CYP2B6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013074387-A1 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2013-05-23 | — | — | WO | disclosed |
| WO-2013074387-A1 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2013-05-23 | — | — | WO | disclosed |