Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MGMT | P16455 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.38 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10595516 | 0.79 | MGMT (0.50) | MAPTRAB9ANPSR1MGMTMEN1 | |
| SCHEMBL8957495 | 0.77 | TSHR (0.47) | ALOX15KMT2APTGS1PTGS2 | |
| SCHEMBL8864691 | 0.77 | PTGS2 (0.40) | MEN1KMT2APTGS1PTGS2 | |
| SCHEMBL8260977 | 0.71 | KMT2A (0.63) | MAPTRAB9AMEN1CYP2C9ALOX15 | |
| Nitroglycerin SCHEMBL27659207 | 0.70 | PTGS2 (0.39) | PTGS1PTGS2 | |
| SCHEMBL493020 | 0.70 | CYP1A2 (0.56) | HSD11B1CHRM2CHRM1CHRM3CHRNB2 | |
| Nitroglycerin SCHEMBL920644 | 0.70 | PTGS2 (0.40) | PTGS1PTGS2 | |
| Nitroglycerin SCHEMBL15421 | 0.70 | PTGS2 (0.40) | PTGS1PTGS2 | |
| SCHEMBL2608867 | 0.70 | CHRM2 (0.48) | MAPTRAB9APRMT5WDR77HSD11B1 | |
| SCHEMBL17722463 | 0.68 | MEN1 (0.54) | MAPTRAB9ANPSR1MGMTMEN1 |
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-2008112227-A1 | TREATMENT WITH NICORANDIL AND OMEGA-3 FATTY ACIDS, AND A COMBINATION PRODUCT THEREOF | RELIANT PHARMACEUTICALS, INC. (US) | 2008-09-18 | — | — | WO | disclosed |
| US-4200640-A | TREATING CIRCULATORY DISEASES | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1980-04-29 | — | — | US | disclosed |