Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | NR4A2 | P43354 | 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 | |
|---|---|---|---|---|
| SCHEMBL556826 | 0.79 | MEN1 (0.36) | ADRB2ADRB1ADRB3MEN1LMNA | |
| SCHEMBL556825 | 0.79 | MEN1 (0.36) | ADRB2ADRB1ADRB3MEN1LMNA | |
| SCHEMBL534508 | 0.69 | MEN1 (0.37) | ADRB2ADRB1ADRB3MEN1LMNA | |
| SCHEMBL534512 | 0.68 | REN (0.42) | RENKCNH2CYP3A4SLC6A4 | |
| SCHEMBL534387 | 0.66 | OPRK1 (0.33) | RENKCNH2 | |
| SCHEMBL534386 | 0.66 | OPRK1 (0.33) | RENKCNH2 | |
| SCHEMBL534595 | 0.65 | OPRK1 (0.40) | ADRB2ADRB1ADRB3MEN1LMNA | |
| SCHEMBL3369539 | 0.64 | ADRB2 (0.54) | ADRB2ADRB1ADRB3MEN1LMNA | |
| SCHEMBL21505013 | 0.64 | ADRB2 (0.50) | KCNH2ADRB2ADRB1ADRB3CYP3A4 | |
| SCHEMBL534037 | 0.62 | ADRB2 (0.50) | ADRB2ADRB1ADRB3MEN1LMNA |
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-2413941-A1 | RENIN INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2012-02-08 | — | — | EP | disclosed |
| WO-2010114978-A1 | RENIN INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2010-10-07 | — | — | WO | disclosed |