Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PBK | Q96KB5 | 1/20 | 0.58 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | EIF2AK4 | Q9P2K8 | 3/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.41 |
| ▸ | JAK3 | P52333 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 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 | |
|---|---|---|---|---|
| SCHEMBL29952582 | 0.74 | HIPK2 (0.35) | PBKJAK3 | |
| SCHEMBL8235149 | 0.74 | PBK (1.00) | PBKLRRK2JAK2JAK3ATR | |
| SCHEMBL18395530 | 0.72 | KMT2A (0.61) | PBKKDM4EKMT2A | |
| SCHEMBL3955342 | 0.72 | PBK (0.70) | PBKLRRK2PRKDCJAK2JAK3 | |
| SCHEMBL1290812 | 0.71 | GPBAR1 (0.57) | PBKLRRK2HSD17B10KDM4EALDH1A1 | |
| SCHEMBL556899 | 0.71 | LMNA (0.39) | — | |
| SCHEMBL300491 | 0.71 | ALOX15 (0.41) | HSD17B10KDM4EALDH1A1HPGDJAK3 | |
| SCHEMBL311710 | 0.69 | BCHE (0.42) | ALDH1A1HPGDJAK2JAK3MEN1 | |
| Hydrochloric Acid SCHEMBL9200760 | 0.69 | ALOX15 (0.39) | KDM4EALDH1A1HPGDJAK3 | |
| SCHEMBL6820246 | 0.69 | EIF2AK4 (0.60) | PBKHSD17B10KDM4EALDH1A1HPGD |
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-2229363-A1 | RENIN INHIBITORS | Merck Frosst Canada Ltd. (CA) | 2010-09-22 | — | — | EP | disclosed |
| WO-2009070869-A1 | RENIN INHIBITORS | MERCK FROSST CANADA LTD. (CA) | 2009-06-11 | — | — | WO | disclosed |