Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | SCN1A | P35498 | 3/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.47 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4667564 | 0.80 | SCN1A (0.65) | SCN1ASCN2ASCN3ALMNAHTT | |
| SCHEMBL8957388 | 0.78 | GSR (0.47) | PTGS1PTGS2HTTHTR2AHRH1 | |
| Nitric Acid SCHEMBL9874458 | 0.77 | GSR (0.47) | SCN1ASCN2ASCN3ALMNAHTT | |
| SCHEMBL14962455 | 0.76 | PTGS2 (0.38) | PTGS1PTGS2SCN1ASCN2ASCN3A | |
| SCHEMBL21382042 | 0.75 | SCN1A (0.55) | SCN1ASCN2ASCN3ALMNAHTT | |
| SCHEMBL9872237 | 0.74 | GSR (0.47) | PTGS1PTGS2LMNACYP1A2CYP2D6 | |
| SCHEMBL8957334 | 0.74 | PTGS2 (0.40) | PTGS1PTGS2LMNAADRA1ACHRM2 | |
| SCHEMBL8957372 | 0.73 | GSR (0.50) | PTGS1PTGS2LMNAHTTCYP1A2 | |
| SCHEMBL4669231 | 0.72 | SLC6A2 (0.61) | SCN1ASCN2ASCN3ALMNAHTT | |
| SCHEMBL4670218 | 0.72 | SCN1A (0.61) | SCN1ASCN2ASCN3ALMNAHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-5049694-A | Cardiovascular disorders | CEDONA PHARMACEUTICALS B.V. (NL) | 1991-09-17 | — | — | US | disclosed |
| EP-0359335-A2 | Pharmaceutical composition having relaxing activity which contains a nitrate ester as active substance | CEDONA PHARMACEUTICALS B.V. (NL) | 1990-03-21 | — | — | EP | disclosed |