Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | THPO | P40225 | 1/20 | 0.30 |
| ▸ | STAT6 | P42226 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | GMNN | O75496 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28072834 | 0.84 | EPHX2 (0.34) | DPP4EPHX2 | |
| SCHEMBL16577977 | 0.80 | DPP4 (0.37) | DPP4EPHX2FFAR3MMP1MAPK1 | |
| SCHEMBL600837 | 0.78 | FFAR3 (0.54) | DPP4EPHX2FFAR3MMP1MAPK1 | |
| SCHEMBL600836 | 0.78 | FFAR3 (0.54) | DPP4EPHX2FFAR3MMP1MAPK1 | |
| SCHEMBL31268179 | 0.77 | EPHX2 (0.32) | EPHX2 | |
| SCHEMBL19696482 | 0.77 | GRM4 (0.47) | DPP4CYP2C19LMNAMTOR | |
| SCHEMBL13165530 | 0.77 | GRM4 (0.47) | DPP4CYP2C19LMNAMTOR | |
| SCHEMBL1320753 | 0.75 | POLB (0.33) | DPP4EPHX2MAPK1LMNASMN1; SMN2 | |
| SCHEMBL3529212 | 0.75 | CYP2C19 (0.41) | FFAR3MAPK1TP53NFKB1CYP2C19 | |
| SCHEMBL10494659 | 0.74 | DPP4 (0.37) | DPP4EPHX2 |
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-2369924-A1 | NITROOXY CYCLOALKANE DERIVATIVES | Merck Sharp & Dohme Corp. (US) | 2011-10-05 | — | — | EP | disclosed |
| WO-2010062415-A1 | NITROOXY CYCLOALKANE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2010-06-03 | — | — | WO | disclosed |